Cymbopogon winterianus, ext.

Substance identity

Identification

Display Name:

Cymbopogon winterianus, ext.

EC Number:

294-954-7

EC Name:

Cymbopogon winterianus, ext.

CAS Number:

91771-61-8

Molecular formula:

Not applicable for UVCB

IUPAC Name:

Essential oil obtained from the leaves of Cymbopogon winterianus, Gramineae by distillation.

Type of Substance

Composition:

UVCB

Origin:

other: Natural Complex Substance (NCS)

Substance Identifiers

EC number

289-753-6

294-954-7

CAS number

8000-29-1

8000-29-1

8000-29-1 / 89998-15-2

91771-61-8

INCI name

CYMBOPOGON WINTERIANUS HERB OIL

Trade name

CITRONELLA EO

CITRONELLA EO CHINA

CITRONELLA EO JAVA

CITRONELLA OIL

CITRONELLA OIL JAVA TYPE

CITRONNELLE CHINE HE

CITRONNELLE HE

CITRONNELLE JAVA HE

CYMBOPOGON WINTERIANUS EO

Citronell oil Java Raw 85/35

Citronella Oil

Citronella Winterianus ext.

Citronella oil Chin. Raw

HUILE ESSENTIELLE DE CITRONNELLE

Oil of citronella Java Type

Compositions

Boundary Composition(s)

Essential oil obtained from the leaves of Cymbopogon winterianus, Gramineae by distillation

State Form:

liquid

Constituent 1

Reference substance name:

(R)-p-mentha-1,8-diene

EC Number:

227-813-5

EC Name:

(R)-p-mentha-1,8-diene

CAS Number:

5989-27-5

Molecular formula:

C10H16

IUPAC Name:

(4R)-1-methyl-4-(prop-1-en-2-yl)cyclohexene

Constituent 2

Reference substance name:

(R)-3,7-dimethyloct-6-enal

EC Number:

219-194-5

EC Name:

(R)-3,7-dimethyloct-6-enal

CAS Number:

2385-77-5

Molecular formula:

C10H18O

IUPAC Name:

3,7-dimethyloct-6-enal

Constituent 3

Reference substance name:

Geraniol

EC Number:

203-377-1

EC Name:

Geraniol

CAS Number:

106-24-1

Molecular formula:

C10H18O

IUPAC Name:

(2E)-3,7-dimethylocta-2,6-dien-1-ol

Constituent 4

Reference substance name:

Citronellol

EC Number:

203-375-0

EC Name:

Citronellol

CAS Number:

106-22-9

Molecular formula:

C10H20O

IUPAC Name:

3,7-dimethyloct-6-en-1-ol

Constituent 5

Reference substance name:

Geranyl acetate

EC Number:

203-341-5

EC Name:

Geranyl acetate

CAS Number:

105-87-3

Molecular formula:

C12H20O2

IUPAC Name:

2,6-Octadien-1-ol, 3,7-dimethyl-, 1-acetate, (2E)-

Constituent 6

Reference substance name:

Camphene

EC Number:

201-234-8

EC Name:

Camphene

CAS Number:

79-92-5

Molecular formula:

C10H16

IUPAC Name:

2,2-dimethyl-3-methylenebicyclo[2.2.1]heptane

Constituent 7

Reference substance name:

Linalool

EC Number:

201-134-4

EC Name:

Linalool

CAS Number:

78-70-6

Molecular formula:

C10H18O

IUPAC Name:

3,7-dimethylocta-1,6-dien-3-ol

Constituent 8

Reference substance name:

Caryophyllene

EC Number:

201-746-1

EC Name:

Caryophyllene

CAS Number:

87-44-5

Molecular formula:

C15H24

IUPAC Name:

4,11,11-trimethyl-8-methylenebicyclo[7.2.0]undec-4-ene

Constituent 9

Reference substance name:

Thuj-4(10)-ene

EC Number:

222-212-4

EC Name:

Thuj-4(10)-ene

CAS Number:

3387-41-5

Molecular formula:

C10H16

IUPAC Name:

Bicyclo(3.1.0)hexane, 4-methylene-1-(1-methylethyl)

Constituent 10

Reference substance name:

7-methyl-3-methyleneocta-1,6-diene

EC Number:

204-622-5

EC Name:

7-methyl-3-methyleneocta-1,6-diene

CAS Number:

123-35-3

Molecular formula:

C10H16

IUPAC Name:

7-methyl-3-methylideneocta-1,6-diene

Constituent 11

Reference substance name:

Mixture of (3Z)-3,7-dimethylocta-1,3,6-triene and (3E)-3,7-dimethylocta-1,3,6-triene

Molecular formula:

(3Z)-3,7-dimethylocta-1,3,6-triene: C10H16 (3E)-3,7-dimethylocta-1,3,6-triene: C10H16

IUPAC Name:

Mixture of (3Z)-3,7-dimethylocta-1,3,6-triene and (3E)-3,7-dimethylocta-1,3,6-triene

Constituent 12

Reference substance name:

Isopulegol

EC Number:

201-940-6

EC Name:

Isopulegol

CAS Number:

89-79-2

Molecular formula:

C10H18O

IUPAC Name:

2-isopropenyl-5-methylcyclohexanol

Constituent 13

Reference substance name:

Cyclohexanol, 5-methyl-2-(1-methylethenyl)-, (1S,2R,5R)-

CAS Number:

96612-21-4

Molecular formula:

C10H18O

IUPAC Name:

Cyclohexanol, 5-methyl-2-(1-methylethenyl)-, (1S,2R,5R)-

Constituent 14

Reference substance name:

Citronellyl acetate

EC Number:

205-775-0

EC Name:

Citronellyl acetate

CAS Number:

150-84-5

Molecular formula:

C12H22O2

IUPAC Name:

3,7-dimethyloct-6-en-1-yl acetate

Constituent 15

Reference substance name:

Mixture of 4,7-dimethyl-1-propan-2-yl-1,2,3,5,6,8a-hexahydronaphthalene (CAS 483-76-1), (1R,4aS,8aS)-7-methyl-4-methylidene-1-propan-2-yl-2,3,4a,5,6,8a-hexahydro-1H-naphthalene (CAS 39029-41-9) and (1S,4aR,8aR)-4,7-dimethyl-1-(propan-2-yl)-1,2,4a,5,6,8a-hexahydronaphthalene (CAS 24406-05-1)

Molecular formula:

(1S,4aR,8aR)-4,7-dimethyl-1-(propan-2-yl)-1,2,4a,5,6,8a-hexahydronaphthalene: C15H24 (1R,4aS,8aS)-7-methyl-4-methylidene-1-propan-2-yl-2,3,4a,5,6,8a-hexahydro-1H-naphthalene: C15H24 4,7-dimethyl-1-propan-2-yl-1,2,3,5,6,8a-hexahydronaphthalene: C15H24

IUPAC Name:

Mixture of 4,7-dimethyl-1-propan-2-yl-1,2,3,5,6,8a-hexahydronaphthalene (CAS 483-76-1), (1R,4aS,8aS)-7-methyl-4-methylidene-1-propan-2-yl-2,3,4a,5,6,8a-hexahydro-1H-naphthalene (CAS 39029-41-9) and (1S,4aR,8aR)-4,7-dimethyl-1-(propan-2-yl)-1,2,4a,5,6,8a-hexahydronaphthalene (CAS 24406-05-1)

Constituent 16

Reference substance name:

2-(4-methylcyclohex-3-en-1-yl)propan-2-ol

EC Number:

701-188-3

CAS Number:

8000-41-7

Molecular formula:

C10H18O

IUPAC Name:

2-(4-methylcyclohex-3-en-1-yl)propan-2-ol

Constituent 17

Reference substance name:

DL-borneol

EC Number:

208-080-0

EC Name:

DL-borneol

CAS Number:

507-70-0

Molecular formula:

C10H18O

IUPAC Name:

1,7,7-trimethylbicyclo[2.2.1]heptan-2-ol

Constituent 18

Reference substance name:

Pin-2(3)-ene

EC Number:

201-291-9

EC Name:

Pin-2(3)-ene

CAS Number:

80-56-8

Molecular formula:

C10H16

IUPAC Name:

4,7,7-trimethylbicyclo[3.1.1]hept-3-ene

Constituent 19

Reference substance name:

(1S,2R,4S)-1-ethenyl-1-methyl-2,4-bis(prop-1-en-2-yl)cyclohexane

CAS Number:

515-13-9

Molecular formula:

C15H24

IUPAC Name:

(1S,2R,4S)-1-ethenyl-1-methyl-2,4-bis(prop-1-en-2-yl)cyclohexane

Constituent 20

Reference substance name:

(1S,2S,4R)-(-)-α,α-dimethyl-1-vinyl-o-menth-8-ene-4-methanol

EC Number:

211-360-5

EC Name:

(1S,2S,4R)-(-)-α,α-dimethyl-1-vinyl-o-menth-8-ene-4-methanol

CAS Number:

639-99-6

Molecular formula:

C15H26O

IUPAC Name:

2-(3-isopropenyl-4-methyl-4-vinylcyclohexyl)propan-2-ol

Constituent 21

Reference substance name:

(1E,6E)-1-methyl-5-methylidene-8-propan-2-ylcyclodeca-1,6-diene

CAS Number:

23986-74-5

Molecular formula:

C15H24

IUPAC Name:

(1E,6E)-1-methyl-5-methylidene-8-propan-2-ylcyclodeca-1,6-diene

Constituent 22

Reference substance name:

Eugenol

EC Number:

202-589-1

EC Name:

Eugenol

CAS Number:

97-53-0

Molecular formula:

C10H12O2

IUPAC Name:

4-allyl-2-methoxyphenol

Constituent 23

Reference substance name:

(E)-3,7-dimethylocta-2,6-dienal

EC Number:

205-476-5

EC Name:

(E)-3,7-dimethylocta-2,6-dienal

CAS Number:

141-27-5

Molecular formula:

C10H16O

IUPAC Name:

(2E)-3,7-dimethylocta-2,6-dienal

Constituent 24

Reference substance name:

Mixture of (1S,4S,4aR,8aS)-1,6-dimethyl-4-propan-2-yl-3,4,4a,7,8,8a-hexahydro-2H-naphthalen-1-ol and (1R,4S,4aR,8aS)-1,6-dimethyl-4-propan-2-yl-3,4,4a,7,8,8a-hexahydro-2H-naphthalen-1-ol

Molecular formula:

(1S,4S,4aR,8aS)-1,6-dimethyl-4-propan-2-yl-3,4,4a,7,8,8a-hexahydro-2H-naphthalen-1-ol: C15H26O (1R,4S,4aR,8aS)-1,6-dimethyl-4-propan-2-yl-3,4,4a,7,8,8a-hexahydro-2H-naphthalen-1-ol: C15H26O

IUPAC Name:

Mixture of (1S,4S,4aR,8aS)-1,6-dimethyl-4-propan-2-yl-3,4,4a,7,8,8a-hexahydro-2H-naphthalen-1-ol and (1R,4S,4aR,8aS)-1,6-dimethyl-4-propan-2-yl-3,4,4a,7,8,8a-hexahydro-2H-naphthalen-1-ol

Constituent 25

Reference substance name:

Nerol

EC Number:

203-378-7

EC Name:

Nerol

CAS Number:

106-25-2

Molecular formula:

C10H18O

IUPAC Name:

2,6-Octadien-1-ol, 3,7-dimethyl-, (2Z)-

Constituent 26

Reference substance name:

p-mentha-1,4(8)-diene

EC Number:

209-578-0

EC Name:

p-mentha-1,4(8)-diene

CAS Number:

586-62-9

Molecular formula:

C10H16

IUPAC Name:

4-isopropylidene-1-methylcyclohexene

Constituent 27

Reference substance name:

Decanal

EC Number:

203-957-4

EC Name:

Decanal

CAS Number:

112-31-2

Molecular formula:

C10H20O

IUPAC Name:

1-decyl aldehyde

Constituent 28

Reference substance name:

Farnesol

EC Number:

225-004-1

EC Name:

Farnesol

CAS Number:

4602-84-0

Molecular formula:

C15H26O

IUPAC Name:

3,7,11-trimethyldodeca-2,6,10-trien-1-ol

Constituent 29

Reference substance name:

p-mentha-1(7),2-diene

EC Number:

209-081-9

EC Name:

p-mentha-1(7),2-diene

CAS Number:

555-10-2

Molecular formula:

C10H16

IUPAC Name:

3-methylidene-6-propan-2-ylcyclohexene

Constituent 30

Reference substance name:

Neryl acetate

EC Number:

205-459-2

EC Name:

Neryl acetate

CAS Number:

141-12-8

Molecular formula:

C12H20O2

IUPAC Name:

2,6-Octadien-1-ol, 3,7-dimethyl-, 1-acetate, (2Z)-

Constituent 31

Reference substance name:

p-cymene

EC Number:

202-796-7

EC Name:

p-cymene

CAS Number:

99-87-6

Molecular formula:

C10H14

IUPAC Name:

1-isopropyl-4-methylbenzene

Constituent 32

Reference substance name:

Unknown and other minor constituents in Cymbopogon winterianus extracts

IUPAC Name:

Unknown and other minor constituents in Cymbopogon winterianus extracts

Essential oil obtained from the leaves of Cymbopogon winterianus, Gramineae by distillation

State Form:

liquid

Constituent 1

Reference substance name:

(R)-p-mentha-1,8-diene

EC Number:

227-813-5

EC Name:

(R)-p-mentha-1,8-diene

CAS Number:

5989-27-5

Molecular formula:

C10H16

IUPAC Name:

(4R)-1-methyl-4-(prop-1-en-2-yl)cyclohexene

Constituent 2

Reference substance name:

(R)-3,7-dimethyloct-6-enal

EC Number:

219-194-5

EC Name:

(R)-3,7-dimethyloct-6-enal

CAS Number:

2385-77-5

Molecular formula:

C10H18O

IUPAC Name:

3,7-dimethyloct-6-enal

Constituent 3

Reference substance name:

Geraniol

EC Number:

203-377-1

EC Name:

Geraniol

CAS Number:

106-24-1

Molecular formula:

C10H18O

IUPAC Name:

(2E)-3,7-dimethylocta-2,6-dien-1-ol

Constituent 4

Reference substance name:

Citronellol

EC Number:

203-375-0

EC Name:

Citronellol

CAS Number:

106-22-9

Molecular formula:

C10H20O

IUPAC Name:

3,7-dimethyloct-6-en-1-ol

Constituent 5

Reference substance name:

Geranyl acetate

EC Number:

203-341-5

EC Name:

Geranyl acetate

CAS Number:

105-87-3

Molecular formula:

C12H20O2

IUPAC Name:

2,6-Octadien-1-ol, 3,7-dimethyl-, 1-acetate, (2E)-

Constituent 6

Reference substance name:

Camphene

EC Number:

201-234-8

EC Name:

Camphene

CAS Number:

79-92-5

Molecular formula:

C10H16

IUPAC Name:

2,2-dimethyl-3-methylenebicyclo[2.2.1]heptane

Constituent 7

Reference substance name:

Linalool

EC Number:

201-134-4

EC Name:

Linalool

CAS Number:

78-70-6

Molecular formula:

C10H18O

IUPAC Name:

3,7-dimethylocta-1,6-dien-3-ol

Constituent 8

Reference substance name:

Caryophyllene

EC Number:

201-746-1

EC Name:

Caryophyllene

CAS Number:

87-44-5

Molecular formula:

C15H24

IUPAC Name:

4,11,11-trimethyl-8-methylenebicyclo[7.2.0]undec-4-ene

Constituent 9

Reference substance name:

Thuj-4(10)-ene

EC Number:

222-212-4

EC Name:

Thuj-4(10)-ene

CAS Number:

3387-41-5

Molecular formula:

C10H16

IUPAC Name:

Bicyclo(3.1.0)hexane, 4-methylene-1-(1-methylethyl)

Constituent 10

Reference substance name:

7-methyl-3-methyleneocta-1,6-diene

EC Number:

204-622-5

EC Name:

7-methyl-3-methyleneocta-1,6-diene

CAS Number:

123-35-3

Molecular formula:

C10H16

IUPAC Name:

7-methyl-3-methylideneocta-1,6-diene

Constituent 11

Reference substance name:

Mixture of (3Z)-3,7-dimethylocta-1,3,6-triene and (3E)-3,7-dimethylocta-1,3,6-triene

Molecular formula:

(3Z)-3,7-dimethylocta-1,3,6-triene: C10H16 (3E)-3,7-dimethylocta-1,3,6-triene: C10H16

IUPAC Name:

Mixture of (3Z)-3,7-dimethylocta-1,3,6-triene and (3E)-3,7-dimethylocta-1,3,6-triene

Constituent 12

Reference substance name:

Isopulegol

EC Number:

201-940-6

EC Name:

Isopulegol

CAS Number:

89-79-2

Molecular formula:

C10H18O

IUPAC Name:

2-isopropenyl-5-methylcyclohexanol

Constituent 13

Reference substance name:

Cyclohexanol, 5-methyl-2-(1-methylethenyl)-, (1S,2R,5R)-

CAS Number:

96612-21-4

Molecular formula:

C10H18O

IUPAC Name:

Cyclohexanol, 5-methyl-2-(1-methylethenyl)-, (1S,2R,5R)-

Constituent 14

Reference substance name:

Citronellyl acetate

EC Number:

205-775-0

EC Name:

Citronellyl acetate

CAS Number:

150-84-5

Molecular formula:

C12H22O2

IUPAC Name:

3,7-dimethyloct-6-en-1-yl acetate

Constituent 15

Reference substance name:

Mixture of 4,7-dimethyl-1-propan-2-yl-1,2,3,5,6,8a-hexahydronaphthalene (CAS 483-76-1), (1R,4aS,8aS)-7-methyl-4-methylidene-1-propan-2-yl-2,3,4a,5,6,8a-hexahydro-1H-naphthalene (CAS 39029-41-9) and (1S,4aR,8aR)-4,7-dimethyl-1-(propan-2-yl)-1,2,4a,5,6,8a-hexahydronaphthalene (CAS 24406-05-1)

Molecular formula:

(1S,4aR,8aR)-4,7-dimethyl-1-(propan-2-yl)-1,2,4a,5,6,8a-hexahydronaphthalene: C15H24 (1R,4aS,8aS)-7-methyl-4-methylidene-1-propan-2-yl-2,3,4a,5,6,8a-hexahydro-1H-naphthalene: C15H24 4,7-dimethyl-1-propan-2-yl-1,2,3,5,6,8a-hexahydronaphthalene: C15H24

IUPAC Name:

Mixture of 4,7-dimethyl-1-propan-2-yl-1,2,3,5,6,8a-hexahydronaphthalene (CAS 483-76-1), (1R,4aS,8aS)-7-methyl-4-methylidene-1-propan-2-yl-2,3,4a,5,6,8a-hexahydro-1H-naphthalene (CAS 39029-41-9) and (1S,4aR,8aR)-4,7-dimethyl-1-(propan-2-yl)-1,2,4a,5,6,8a-hexahydronaphthalene (CAS 24406-05-1)

Constituent 16

Reference substance name:

Terpineol

EC Number:

232-268-1

EC Name:

Terpineol

CAS Number:

8000-41-7

Molecular formula:

C10H18O

IUPAC Name:

2-(4-methylcyclohex-3-en-1-yl)propan-2-ol

Constituent 17

Reference substance name:

DL-borneol

EC Number:

208-080-0

EC Name:

DL-borneol

CAS Number:

507-70-0

Molecular formula:

C10H18O

IUPAC Name:

1,7,7-trimethylbicyclo[2.2.1]heptan-2-ol

Constituent 18

Reference substance name:

Pin-2(3)-ene

EC Number:

201-291-9

EC Name:

Pin-2(3)-ene

CAS Number:

80-56-8

Molecular formula:

C10H16

IUPAC Name:

4,7,7-trimethylbicyclo[3.1.1]hept-3-ene

Constituent 19

Reference substance name:

(1S,2R,4S)-1-ethenyl-1-methyl-2,4-bis(prop-1-en-2-yl)cyclohexane

CAS Number:

515-13-9

Molecular formula:

C15H24

IUPAC Name:

(1S,2R,4S)-1-ethenyl-1-methyl-2,4-bis(prop-1-en-2-yl)cyclohexane

Constituent 20

Reference substance name:

(1S,2S,4R)-(-)-α,α-dimethyl-1-vinyl-o-menth-8-ene-4-methanol

EC Number:

211-360-5

EC Name:

(1S,2S,4R)-(-)-α,α-dimethyl-1-vinyl-o-menth-8-ene-4-methanol

CAS Number:

639-99-6

Molecular formula:

C15H26O

IUPAC Name:

2-(3-isopropenyl-4-methyl-4-vinylcyclohexyl)propan-2-ol

Constituent 21

Reference substance name:

(1E,6E)-1-methyl-5-methylidene-8-propan-2-ylcyclodeca-1,6-diene

CAS Number:

23986-74-5

Molecular formula:

C15H24

IUPAC Name:

(1E,6E)-1-methyl-5-methylidene-8-propan-2-ylcyclodeca-1,6-diene

Constituent 22

Reference substance name:

Eugenol

EC Number:

202-589-1

EC Name:

Eugenol

CAS Number:

97-53-0

Molecular formula:

C10H12O2

IUPAC Name:

4-allyl-2-methoxyphenol

Constituent 23

Reference substance name:

(E)-3,7-dimethylocta-2,6-dienal

EC Number:

205-476-5

EC Name:

(E)-3,7-dimethylocta-2,6-dienal

CAS Number:

141-27-5

Molecular formula:

C10H16O

IUPAC Name:

(2E)-3,7-dimethylocta-2,6-dienal

Constituent 24

Reference substance name:

Mixture of (1S,4S,4aR,8aS)-1,6-dimethyl-4-propan-2-yl-3,4,4a,7,8,8a-hexahydro-2H-naphthalen-1-ol and (1R,4S,4aR,8aS)-1,6-dimethyl-4-propan-2-yl-3,4,4a,7,8,8a-hexahydro-2H-naphthalen-1-ol

Molecular formula:

(1S,4S,4aR,8aS)-1,6-dimethyl-4-propan-2-yl-3,4,4a,7,8,8a-hexahydro-2H-naphthalen-1-ol: C15H26O (1R,4S,4aR,8aS)-1,6-dimethyl-4-propan-2-yl-3,4,4a,7,8,8a-hexahydro-2H-naphthalen-1-ol: C15H26O

IUPAC Name:

Mixture of (1S,4S,4aR,8aS)-1,6-dimethyl-4-propan-2-yl-3,4,4a,7,8,8a-hexahydro-2H-naphthalen-1-ol and (1R,4S,4aR,8aS)-1,6-dimethyl-4-propan-2-yl-3,4,4a,7,8,8a-hexahydro-2H-naphthalen-1-ol

Constituent 25

Reference substance name:

Nerol

EC Number:

203-378-7

EC Name:

Nerol

CAS Number:

106-25-2

Molecular formula:

C10H18O

IUPAC Name:

2,6-Octadien-1-ol, 3,7-dimethyl-, (2Z)-

Constituent 26

Reference substance name:

p-mentha-1,4(8)-diene

EC Number:

209-578-0

EC Name:

p-mentha-1,4(8)-diene

CAS Number:

586-62-9

Molecular formula:

C10H16

IUPAC Name:

4-isopropylidene-1-methylcyclohexene

Constituent 27

Reference substance name:

Decanal

EC Number:

203-957-4

EC Name:

Decanal

CAS Number:

112-31-2

Molecular formula:

C10H20O

IUPAC Name:

1-decyl aldehyde

Constituent 28

Reference substance name:

Farnesol

EC Number:

225-004-1

EC Name:

Farnesol

CAS Number:

4602-84-0

Molecular formula:

C15H26O

IUPAC Name:

3,7,11-trimethyldodeca-2,6,10-trien-1-ol

Constituent 29

Reference substance name:

p-mentha-1(7),2-diene

EC Number:

209-081-9

EC Name:

p-mentha-1(7),2-diene

CAS Number:

555-10-2

Molecular formula:

C10H16

IUPAC Name:

3-methylidene-6-propan-2-ylcyclohexene

Constituent 30

Reference substance name:

Neryl acetate

EC Number:

205-459-2

EC Name:

Neryl acetate

CAS Number:

141-12-8

Molecular formula:

C12H20O2

IUPAC Name:

2,6-Octadien-1-ol, 3,7-dimethyl-, 1-acetate, (2Z)-

Constituent 31

Reference substance name:

p-cymene

EC Number:

202-796-7

EC Name:

p-cymene

CAS Number:

99-87-6

Molecular formula:

C10H14

IUPAC Name:

1-isopropyl-4-methylbenzene

Constituent 32

Reference substance name:

Unknown and other minor constituents in Cymbopogon winterianus extracts

IUPAC Name:

Unknown and other minor constituents in Cymbopogon winterianus extracts

Legal Entity Composition(s)

Essential oil obtained from the leaves of Cymbopogon winterianus, Gramineae by distillation

State Form:

liquid

Constituent 1

Reference substance name:

(R)-p-mentha-1,8-diene

EC Number:

227-813-5

EC Name:

(R)-p-mentha-1,8-diene

CAS Number:

5989-27-5

Molecular formula:

C10H16

IUPAC Name:

(4R)-1-methyl-4-(prop-1-en-2-yl)cyclohexene

Constituent 2

Reference substance name:

(R)-3,7-dimethyloct-6-enal

EC Number:

219-194-5

EC Name:

(R)-3,7-dimethyloct-6-enal

CAS Number:

2385-77-5

Molecular formula:

C10H18O

IUPAC Name:

3,7-dimethyloct-6-enal

Constituent 3

Reference substance name:

Geraniol

EC Number:

203-377-1

EC Name:

Geraniol

CAS Number:

106-24-1

Molecular formula:

C10H18O

IUPAC Name:

(2E)-3,7-dimethylocta-2,6-dien-1-ol

Constituent 4

Reference substance name:

Citronellol

EC Number:

203-375-0

EC Name:

Citronellol

CAS Number:

106-22-9

Molecular formula:

C10H20O

IUPAC Name:

3,7-dimethyloct-6-en-1-ol

Constituent 5

Reference substance name:

Geranyl acetate

EC Number:

203-341-5

EC Name:

Geranyl acetate

CAS Number:

105-87-3

Molecular formula:

C12H20O2

IUPAC Name:

2,6-Octadien-1-ol, 3,7-dimethyl-, 1-acetate, (2E)-

Constituent 6

Reference substance name:

Camphene

EC Number:

201-234-8

EC Name:

Camphene

CAS Number:

79-92-5

Molecular formula:

C10H16

IUPAC Name:

2,2-dimethyl-3-methylenebicyclo[2.2.1]heptane

Constituent 7

Reference substance name:

Linalool

EC Number:

201-134-4

EC Name:

Linalool

CAS Number:

78-70-6

Molecular formula:

C10H18O

IUPAC Name:

3,7-dimethylocta-1,6-dien-3-ol

Constituent 8

Reference substance name:

Caryophyllene

EC Number:

201-746-1

EC Name:

Caryophyllene

CAS Number:

87-44-5

Molecular formula:

C15H24

IUPAC Name:

4,11,11-trimethyl-8-methylenebicyclo[7.2.0]undec-4-ene

Constituent 9

Reference substance name:

Thuj-4(10)-ene

EC Number:

222-212-4

EC Name:

Thuj-4(10)-ene

CAS Number:

3387-41-5

Molecular formula:

C10H16

IUPAC Name:

Bicyclo(3.1.0)hexane, 4-methylene-1-(1-methylethyl)

Constituent 10

Reference substance name:

7-methyl-3-methyleneocta-1,6-diene

EC Number:

204-622-5

EC Name:

7-methyl-3-methyleneocta-1,6-diene

CAS Number:

123-35-3

Molecular formula:

C10H16

IUPAC Name:

7-methyl-3-methylideneocta-1,6-diene

Constituent 11

Reference substance name:

Mixture of (3Z)-3,7-dimethylocta-1,3,6-triene and (3E)-3,7-dimethylocta-1,3,6-triene

Molecular formula:

(3Z)-3,7-dimethylocta-1,3,6-triene: C10H16 (3E)-3,7-dimethylocta-1,3,6-triene: C10H16

IUPAC Name:

Mixture of (3Z)-3,7-dimethylocta-1,3,6-triene and (3E)-3,7-dimethylocta-1,3,6-triene

Constituent 12

Reference substance name:

Isopulegol

EC Number:

201-940-6

EC Name:

Isopulegol

CAS Number:

89-79-2

Molecular formula:

C10H18O

IUPAC Name:

2-isopropenyl-5-methylcyclohexanol

Constituent 13

Reference substance name:

Cyclohexanol, 5-methyl-2-(1-methylethenyl)-, (1S,2R,5R)-

CAS Number:

96612-21-4

Molecular formula:

C10H18O

IUPAC Name:

Cyclohexanol, 5-methyl-2-(1-methylethenyl)-, (1S,2R,5R)-

Constituent 14

Reference substance name:

Citronellyl acetate

EC Number:

205-775-0

EC Name:

Citronellyl acetate

CAS Number:

150-84-5

Molecular formula:

C12H22O2

IUPAC Name:

3,7-dimethyloct-6-en-1-yl acetate

Constituent 15

Reference substance name:

Mixture of 4,7-dimethyl-1-propan-2-yl-1,2,3,5,6,8a-hexahydronaphthalene (CAS 483-76-1), (1R,4aS,8aS)-7-methyl-4-methylidene-1-propan-2-yl-2,3,4a,5,6,8a-hexahydro-1H-naphthalene (CAS 39029-41-9) and (1S,4aR,8aR)-4,7-dimethyl-1-(propan-2-yl)-1,2,4a,5,6,8a-hexahydronaphthalene (CAS 24406-05-1)

Molecular formula:

(1S,4aR,8aR)-4,7-dimethyl-1-(propan-2-yl)-1,2,4a,5,6,8a-hexahydronaphthalene: C15H24 (1R,4aS,8aS)-7-methyl-4-methylidene-1-propan-2-yl-2,3,4a,5,6,8a-hexahydro-1H-naphthalene: C15H24 4,7-dimethyl-1-propan-2-yl-1,2,3,5,6,8a-hexahydronaphthalene: C15H24

IUPAC Name:

Mixture of 4,7-dimethyl-1-propan-2-yl-1,2,3,5,6,8a-hexahydronaphthalene (CAS 483-76-1), (1R,4aS,8aS)-7-methyl-4-methylidene-1-propan-2-yl-2,3,4a,5,6,8a-hexahydro-1H-naphthalene (CAS 39029-41-9) and (1S,4aR,8aR)-4,7-dimethyl-1-(propan-2-yl)-1,2,4a,5,6,8a-hexahydronaphthalene (CAS 24406-05-1)

Constituent 16

Reference substance name:

2-(4-methylcyclohex-3-en-1-yl)propan-2-ol

EC Number:

701-188-3

CAS Number:

8000-41-7

Molecular formula:

C10H18O

IUPAC Name:

2-(4-methylcyclohex-3-en-1-yl)propan-2-ol

Constituent 17

Reference substance name:

DL-borneol

EC Number:

208-080-0

EC Name:

DL-borneol

CAS Number:

507-70-0

Molecular formula:

C10H18O

IUPAC Name:

1,7,7-trimethylbicyclo[2.2.1]heptan-2-ol

Constituent 18

Reference substance name:

Pin-2(3)-ene

EC Number:

201-291-9

EC Name:

Pin-2(3)-ene

CAS Number:

80-56-8

Molecular formula:

C10H16

IUPAC Name:

4,7,7-trimethylbicyclo[3.1.1]hept-3-ene

Constituent 19

Reference substance name:

(1S,2R,4S)-1-ethenyl-1-methyl-2,4-bis(prop-1-en-2-yl)cyclohexane

CAS Number:

515-13-9

Molecular formula:

C15H24

IUPAC Name:

(1S,2R,4S)-1-ethenyl-1-methyl-2,4-bis(prop-1-en-2-yl)cyclohexane

Constituent 20

Reference substance name:

(1S,2S,4R)-(-)-α,α-dimethyl-1-vinyl-o-menth-8-ene-4-methanol

EC Number:

211-360-5

EC Name:

(1S,2S,4R)-(-)-α,α-dimethyl-1-vinyl-o-menth-8-ene-4-methanol

CAS Number:

639-99-6

Molecular formula:

C15H26O

IUPAC Name:

2-(3-isopropenyl-4-methyl-4-vinylcyclohexyl)propan-2-ol

Constituent 21

Reference substance name:

(1E,6E)-1-methyl-5-methylidene-8-propan-2-ylcyclodeca-1,6-diene

CAS Number:

23986-74-5

Molecular formula:

C15H24

IUPAC Name:

(1E,6E)-1-methyl-5-methylidene-8-propan-2-ylcyclodeca-1,6-diene

Constituent 22

Reference substance name:

Eugenol

EC Number:

202-589-1

EC Name:

Eugenol

CAS Number:

97-53-0

Molecular formula:

C10H12O2

IUPAC Name:

4-allyl-2-methoxyphenol

Constituent 23

Reference substance name:

(E)-3,7-dimethylocta-2,6-dienal

EC Number:

205-476-5

EC Name:

(E)-3,7-dimethylocta-2,6-dienal

CAS Number:

141-27-5

Molecular formula:

C10H16O

IUPAC Name:

(2E)-3,7-dimethylocta-2,6-dienal

Constituent 24

Reference substance name:

Mixture of (1S,4S,4aR,8aS)-1,6-dimethyl-4-propan-2-yl-3,4,4a,7,8,8a-hexahydro-2H-naphthalen-1-ol and (1R,4S,4aR,8aS)-1,6-dimethyl-4-propan-2-yl-3,4,4a,7,8,8a-hexahydro-2H-naphthalen-1-ol

Molecular formula:

(1S,4S,4aR,8aS)-1,6-dimethyl-4-propan-2-yl-3,4,4a,7,8,8a-hexahydro-2H-naphthalen-1-ol: C15H26O (1R,4S,4aR,8aS)-1,6-dimethyl-4-propan-2-yl-3,4,4a,7,8,8a-hexahydro-2H-naphthalen-1-ol: C15H26O

IUPAC Name:

Mixture of (1S,4S,4aR,8aS)-1,6-dimethyl-4-propan-2-yl-3,4,4a,7,8,8a-hexahydro-2H-naphthalen-1-ol and (1R,4S,4aR,8aS)-1,6-dimethyl-4-propan-2-yl-3,4,4a,7,8,8a-hexahydro-2H-naphthalen-1-ol

Constituent 25

Reference substance name:

Nerol

EC Number:

203-378-7

EC Name:

Nerol

CAS Number:

106-25-2

Molecular formula:

C10H18O

IUPAC Name:

2,6-Octadien-1-ol, 3,7-dimethyl-, (2Z)-

Constituent 26

Reference substance name:

p-mentha-1,4(8)-diene

EC Number:

209-578-0

EC Name:

p-mentha-1,4(8)-diene

CAS Number:

586-62-9

Molecular formula:

C10H16

IUPAC Name:

4-isopropylidene-1-methylcyclohexene

Constituent 27

Reference substance name:

Decanal

EC Number:

203-957-4

EC Name:

Decanal

CAS Number:

112-31-2

Molecular formula:

C10H20O

IUPAC Name:

1-decyl aldehyde

Constituent 28

Reference substance name:

Farnesol

EC Number:

225-004-1

EC Name:

Farnesol

CAS Number:

4602-84-0

Molecular formula:

C15H26O

IUPAC Name:

3,7,11-trimethyldodeca-2,6,10-trien-1-ol

Constituent 29

Reference substance name:

p-mentha-1(7),2-diene

EC Number:

209-081-9

EC Name:

p-mentha-1(7),2-diene

CAS Number:

555-10-2

Molecular formula:

C10H16

IUPAC Name:

3-methylidene-6-propan-2-ylcyclohexene

Constituent 30

Reference substance name:

Neryl acetate

EC Number:

205-459-2

EC Name:

Neryl acetate

CAS Number:

141-12-8

Molecular formula:

C12H20O2

IUPAC Name:

2,6-Octadien-1-ol, 3,7-dimethyl-, 1-acetate, (2Z)-

Constituent 31

Reference substance name:

p-cymene

EC Number:

202-796-7

EC Name:

p-cymene

CAS Number:

99-87-6

Molecular formula:

C10H14

IUPAC Name:

1-isopropyl-4-methylbenzene

Constituent 32

Reference substance name:

Unknown and other minor constituents in Cymbopogon winterianus extracts

IUPAC Name:

Unknown and other minor constituents in Cymbopogon winterianus extracts

Cymbopogon Winterianus

State Form:

liquid

Constituent 1

Reference substance name:

(1α,2β,4β)-1-methyl-2,4-bis(methylvinyl)-1-vinylcyclohexane

EC Number:

251-713-0

EC Name:

(1α,2β,4β)-1-methyl-2,4-bis(methylvinyl)-1-vinylcyclohexane

CAS Number:

33880-83-0

Molecular formula:

C15H24

IUPAC Name:

rel-(1R,2R,4S)-1-methyl-2,4-di(prop-1-en-2-yl)-1-vinylcyclohexane

Constituent 2

Reference substance name:

(±)-(1α,2β,5α)-5-methyl-2-(1-methylvinyl)cyclohexan-1-ol

EC Number:

256-557-7

EC Name:

(±)-(1α,2β,5α)-5-methyl-2-(1-methylvinyl)cyclohexan-1-ol

CAS Number:

50373-36-9

Molecular formula:

C10H18O

IUPAC Name:

rel-(1R,2S,5R)-5-methyl-2-(prop-1-en-2-yl)cyclohexanol

Constituent 3

Reference substance name:

(1E,6E)-8-isopropyl-1-methyl-5-methylenecyclodeca-1,6-diene

CAS Number:

105453-16-5

Molecular formula:

C15H24

IUPAC Name:

(1E,6E)-8-isopropyl-1-methyl-5-methylenecyclodeca-1,6-diene

Constituent 4

Reference substance name:

rel-(1R,8aS)-1-isopropyl-4,7-dimethyl-1,2,3,5,6,8a-hexahydronaphthalene

CAS Number:

60305-17-1

Molecular formula:

C15H24

IUPAC Name:

rel-(1R,8aS)-1-isopropyl-4,7-dimethyl-1,2,3,5,6,8a-hexahydronaphthalene

Constituent 5

Reference substance name:

rel-(1R,4aS,8aS)-1-isopropyl-7-methyl-4-methylene-1,2,3,4,4a,5,6,8a-octahydronaphthalene

CAS Number:

39029-41-9

Molecular formula:

C15H24

IUPAC Name:

rel-(1R,4aS,8aS)-1-isopropyl-7-methyl-4-methylene-1,2,3,4,4a,5,6,8a-octahydronaphthalene

Constituent 6

Reference substance name:

Citronellyl acetate

EC Number:

205-775-0

EC Name:

Citronellyl acetate

CAS Number:

150-84-5

Molecular formula:

C12H22O2

IUPAC Name:

3,7-dimethyloct-6-en-1-yl acetate

Constituent 7

Reference substance name:

rel-2-((1R,3S,4S)-4-methyl-3-(prop-1-en-2-yl)-4-vinylcyclohexyl)propan-2-ol

CAS Number:

23811-48-5

Molecular formula:

C15H26O

IUPAC Name:

rel-2-((1R,3S,4S)-4-methyl-3-(prop-1-en-2-yl)-4-vinylcyclohexyl)propan-2-ol

Constituent 8

Reference substance name:

Dipentene

EC Number:

205-341-0

EC Name:

Dipentene

CAS Number:

138-86-3

Molecular formula:

C10H16

IUPAC Name:

1-methyl-4-(prop-1-en-2-yl)cyclohex-1-ene

Constituent 9

Reference substance name:

Geranyl acetate

EC Number:

203-341-5

EC Name:

Geranyl acetate

CAS Number:

105-87-3

Molecular formula:

C12H20O2

IUPAC Name:

2,6-Octadien-1-ol, 3,7-dimethyl-, 1-acetate, (2E)-

Constituent 10

Reference substance name:

Citronellol

EC Number:

203-375-0

EC Name:

Citronellol

CAS Number:

106-22-9

Molecular formula:

C10H20O

IUPAC Name:

3,7-dimethyloct-6-en-1-ol

Constituent 11

Reference substance name:

Citronellal

EC Number:

203-376-6

EC Name:

Citronellal

CAS Number:

106-23-0

Molecular formula:

C10H18O

IUPAC Name:

3,7-dimethyloct-6-enal

Constituent 12

Reference substance name:

Geraniol

EC Number:

203-377-1

EC Name:

Geraniol

CAS Number:

106-24-1

Molecular formula:

C10H18O

IUPAC Name:

(2E)-3,7-dimethylocta-2,6-dien-1-ol

Essential oil obtained from the leaves of Cymbopogon winterianus, Gramineae by distillation

State Form:

liquid

Constituent 1

Reference substance name:

(R)-p-mentha-1,8-diene

EC Number:

227-813-5

EC Name:

(R)-p-mentha-1,8-diene

CAS Number:

5989-27-5

Molecular formula:

C10H16

IUPAC Name:

(4R)-1-methyl-4-(prop-1-en-2-yl)cyclohexene

Constituent 2

Reference substance name:

(R)-3,7-dimethyloct-6-enal

EC Number:

219-194-5

EC Name:

(R)-3,7-dimethyloct-6-enal

CAS Number:

2385-77-5

Molecular formula:

C10H18O

IUPAC Name:

3,7-dimethyloct-6-enal

Constituent 3

Reference substance name:

Geraniol

EC Number:

203-377-1

EC Name:

Geraniol

CAS Number:

106-24-1

Molecular formula:

C10H18O

IUPAC Name:

(2E)-3,7-dimethylocta-2,6-dien-1-ol

Constituent 4

Reference substance name:

Citronellol

EC Number:

203-375-0

EC Name:

Citronellol

CAS Number:

106-22-9

Molecular formula:

C10H20O

IUPAC Name:

3,7-dimethyloct-6-en-1-ol

Constituent 5

Reference substance name:

Geranyl acetate

EC Number:

203-341-5

EC Name:

Geranyl acetate

CAS Number:

105-87-3

Molecular formula:

C12H20O2

IUPAC Name:

2,6-Octadien-1-ol, 3,7-dimethyl-, 1-acetate, (2E)-

Constituent 6

Reference substance name:

Camphene

EC Number:

201-234-8

EC Name:

Camphene

CAS Number:

79-92-5

Molecular formula:

C10H16

IUPAC Name:

2,2-dimethyl-3-methylenebicyclo[2.2.1]heptane

Constituent 7

Reference substance name:

Linalool

EC Number:

201-134-4

EC Name:

Linalool

CAS Number:

78-70-6

Molecular formula:

C10H18O

IUPAC Name:

3,7-dimethylocta-1,6-dien-3-ol

Constituent 8

Reference substance name:

Caryophyllene

EC Number:

201-746-1

EC Name:

Caryophyllene

CAS Number:

87-44-5

Molecular formula:

C15H24

IUPAC Name:

4,11,11-trimethyl-8-methylenebicyclo[7.2.0]undec-4-ene

Constituent 9

Reference substance name:

Thuj-4(10)-ene

EC Number:

222-212-4

EC Name:

Thuj-4(10)-ene

CAS Number:

3387-41-5

Molecular formula:

C10H16

IUPAC Name:

Bicyclo(3.1.0)hexane, 4-methylene-1-(1-methylethyl)

Constituent 10

Reference substance name:

7-methyl-3-methyleneocta-1,6-diene

EC Number:

204-622-5

EC Name:

7-methyl-3-methyleneocta-1,6-diene

CAS Number:

123-35-3

Molecular formula:

C10H16

IUPAC Name:

7-methyl-3-methylideneocta-1,6-diene

Constituent 11

Reference substance name:

Mixture of (3Z)-3,7-dimethylocta-1,3,6-triene and (3E)-3,7-dimethylocta-1,3,6-triene

Molecular formula:

(3Z)-3,7-dimethylocta-1,3,6-triene: C10H16 (3E)-3,7-dimethylocta-1,3,6-triene: C10H16

IUPAC Name:

Mixture of (3Z)-3,7-dimethylocta-1,3,6-triene and (3E)-3,7-dimethylocta-1,3,6-triene

Constituent 12

Reference substance name:

Cyclohexanol, 5-methyl-2-(1-methylethenyl)-, (1S,2R,5R)-

CAS Number:

96612-21-4

Molecular formula:

C10H18O

IUPAC Name:

Cyclohexanol, 5-methyl-2-(1-methylethenyl)-, (1S,2R,5R)-

Constituent 13

Reference substance name:

Citronellyl acetate

EC Number:

205-775-0

EC Name:

Citronellyl acetate

CAS Number:

150-84-5

Molecular formula:

C12H22O2

IUPAC Name:

3,7-dimethyloct-6-en-1-yl acetate

Constituent 14

Reference substance name:

Mixture of 4,7-dimethyl-1-propan-2-yl-1,2,3,5,6,8a-hexahydronaphthalene (CAS 483-76-1), (1R,4aS,8aS)-7-methyl-4-methylidene-1-propan-2-yl-2,3,4a,5,6,8a-hexahydro-1H-naphthalene (CAS 39029-41-9) and (1S,4aR,8aR)-4,7-dimethyl-1-(propan-2-yl)-1,2,4a,5,6,8a-hexahydronaphthalene (CAS 24406-05-1)

Molecular formula:

(1S,4aR,8aR)-4,7-dimethyl-1-(propan-2-yl)-1,2,4a,5,6,8a-hexahydronaphthalene: C15H24 (1R,4aS,8aS)-7-methyl-4-methylidene-1-propan-2-yl-2,3,4a,5,6,8a-hexahydro-1H-naphthalene: C15H24 4,7-dimethyl-1-propan-2-yl-1,2,3,5,6,8a-hexahydronaphthalene: C15H24

IUPAC Name:

Mixture of 4,7-dimethyl-1-propan-2-yl-1,2,3,5,6,8a-hexahydronaphthalene (CAS 483-76-1), (1R,4aS,8aS)-7-methyl-4-methylidene-1-propan-2-yl-2,3,4a,5,6,8a-hexahydro-1H-naphthalene (CAS 39029-41-9) and (1S,4aR,8aR)-4,7-dimethyl-1-(propan-2-yl)-1,2,4a,5,6,8a-hexahydronaphthalene (CAS 24406-05-1)

Constituent 15

Reference substance name:

2-(4-methylcyclohex-3-en-1-yl)propan-2-ol

EC Number:

701-188-3

CAS Number:

8000-41-7

Molecular formula:

C10H18O

IUPAC Name:

2-(4-methylcyclohex-3-en-1-yl)propan-2-ol

Constituent 16

Reference substance name:

DL-borneol

EC Number:

208-080-0

EC Name:

DL-borneol

CAS Number:

507-70-0

Molecular formula:

C10H18O

IUPAC Name:

1,7,7-trimethylbicyclo[2.2.1]heptan-2-ol

Constituent 17

Reference substance name:

Pin-2(3)-ene

EC Number:

201-291-9

EC Name:

Pin-2(3)-ene

CAS Number:

80-56-8

Molecular formula:

C10H16

IUPAC Name:

4,7,7-trimethylbicyclo[3.1.1]hept-3-ene

Constituent 18

Reference substance name:

(1S,2R,4S)-1-ethenyl-1-methyl-2,4-bis(prop-1-en-2-yl)cyclohexane

CAS Number:

515-13-9

Molecular formula:

C15H24

IUPAC Name:

(1S,2R,4S)-1-ethenyl-1-methyl-2,4-bis(prop-1-en-2-yl)cyclohexane

Constituent 19

Reference substance name:

(1S,2S,4R)-(-)-α,α-dimethyl-1-vinyl-o-menth-8-ene-4-methanol

EC Number:

211-360-5

EC Name:

(1S,2S,4R)-(-)-α,α-dimethyl-1-vinyl-o-menth-8-ene-4-methanol

CAS Number:

639-99-6

Molecular formula:

C15H26O

IUPAC Name:

2-(3-isopropenyl-4-methyl-4-vinylcyclohexyl)propan-2-ol

Constituent 20

Reference substance name:

(1E,6E)-1-methyl-5-methylidene-8-propan-2-ylcyclodeca-1,6-diene

CAS Number:

23986-74-5

Molecular formula:

C15H24

IUPAC Name:

(1E,6E)-1-methyl-5-methylidene-8-propan-2-ylcyclodeca-1,6-diene

Constituent 21

Reference substance name:

Eugenol

EC Number:

202-589-1

EC Name:

Eugenol

CAS Number:

97-53-0

Molecular formula:

C10H12O2

IUPAC Name:

4-allyl-2-methoxyphenol

Constituent 22

Reference substance name:

(E)-3,7-dimethylocta-2,6-dienal

EC Number:

205-476-5

EC Name:

(E)-3,7-dimethylocta-2,6-dienal

CAS Number:

141-27-5

Molecular formula:

C10H16O

IUPAC Name:

(2E)-3,7-dimethylocta-2,6-dienal

Constituent 23

Reference substance name:

Mixture of (1S,4S,4aR,8aS)-1,6-dimethyl-4-propan-2-yl-3,4,4a,7,8,8a-hexahydro-2H-naphthalen-1-ol and (1R,4S,4aR,8aS)-1,6-dimethyl-4-propan-2-yl-3,4,4a,7,8,8a-hexahydro-2H-naphthalen-1-ol

Molecular formula:

(1S,4S,4aR,8aS)-1,6-dimethyl-4-propan-2-yl-3,4,4a,7,8,8a-hexahydro-2H-naphthalen-1-ol: C15H26O (1R,4S,4aR,8aS)-1,6-dimethyl-4-propan-2-yl-3,4,4a,7,8,8a-hexahydro-2H-naphthalen-1-ol: C15H26O

IUPAC Name:

Mixture of (1S,4S,4aR,8aS)-1,6-dimethyl-4-propan-2-yl-3,4,4a,7,8,8a-hexahydro-2H-naphthalen-1-ol and (1R,4S,4aR,8aS)-1,6-dimethyl-4-propan-2-yl-3,4,4a,7,8,8a-hexahydro-2H-naphthalen-1-ol

Constituent 24

Reference substance name:

Nerol

EC Number:

203-378-7

EC Name:

Nerol

CAS Number:

106-25-2

Molecular formula:

C10H18O

IUPAC Name:

2,6-Octadien-1-ol, 3,7-dimethyl-, (2Z)-

Constituent 25

Reference substance name:

p-mentha-1,4(8)-diene

EC Number:

209-578-0

EC Name:

p-mentha-1,4(8)-diene

CAS Number:

586-62-9

Molecular formula:

C10H16

IUPAC Name:

4-isopropylidene-1-methylcyclohexene

Constituent 26

Reference substance name:

Decanal

EC Number:

203-957-4

EC Name:

Decanal

CAS Number:

112-31-2

Molecular formula:

C10H20O

IUPAC Name:

1-decyl aldehyde

Constituent 27

Reference substance name:

Farnesol

EC Number:

225-004-1

EC Name:

Farnesol

CAS Number:

4602-84-0

Molecular formula:

C15H26O

IUPAC Name:

3,7,11-trimethyldodeca-2,6,10-trien-1-ol

Constituent 28

Reference substance name:

p-mentha-1(7),2-diene

EC Number:

209-081-9

EC Name:

p-mentha-1(7),2-diene

CAS Number:

555-10-2

Molecular formula:

C10H16

IUPAC Name:

3-methylidene-6-propan-2-ylcyclohexene

Constituent 29

Reference substance name:

Neryl acetate

EC Number:

205-459-2

EC Name:

Neryl acetate

CAS Number:

141-12-8

Molecular formula:

C12H20O2

IUPAC Name:

2,6-Octadien-1-ol, 3,7-dimethyl-, 1-acetate, (2Z)-

Constituent 30

Reference substance name:

p-cymene

EC Number:

202-796-7

EC Name:

p-cymene

CAS Number:

99-87-6

Molecular formula:

C10H14

IUPAC Name:

1-isopropyl-4-methylbenzene

Constituent 31

Reference substance name:

Mix of minor constituents

CAS Number:

Mix of minor constituents

Molecular formula:

Not applicable.

IUPAC Name:

Mix of minor constituents

Essential oil obtained from the leaves of Cymbopogon winterianus, Gramineae by distillation

State Form:

liquid

Constituent 1

Reference substance name:

(R)-p-mentha-1,8-diene

EC Number:

227-813-5

EC Name:

(R)-p-mentha-1,8-diene

CAS Number:

5989-27-5

Molecular formula:

C10H16

IUPAC Name:

(4R)-1-methyl-4-(prop-1-en-2-yl)cyclohexene

Constituent 2

Reference substance name:

(R)-3,7-dimethyloct-6-enal

EC Number:

219-194-5

EC Name:

(R)-3,7-dimethyloct-6-enal

CAS Number:

2385-77-5

Molecular formula:

C10H18O

IUPAC Name:

3,7-dimethyloct-6-enal

Constituent 3

Reference substance name:

Geraniol

EC Number:

203-377-1

EC Name:

Geraniol

CAS Number:

106-24-1

Molecular formula:

C10H18O

IUPAC Name:

(2E)-3,7-dimethylocta-2,6-dien-1-ol

Constituent 4

Reference substance name:

Citronellol

EC Number:

203-375-0

EC Name:

Citronellol

CAS Number:

106-22-9

Molecular formula:

C10H20O

IUPAC Name:

3,7-dimethyloct-6-en-1-ol

Constituent 5

Reference substance name:

Geranyl acetate

EC Number:

203-341-5

EC Name:

Geranyl acetate

CAS Number:

105-87-3

Molecular formula:

C12H20O2

IUPAC Name:

2,6-Octadien-1-ol, 3,7-dimethyl-, 1-acetate, (2E)-

Constituent 6

Reference substance name:

Camphene

EC Number:

201-234-8

EC Name:

Camphene

CAS Number:

79-92-5

Molecular formula:

C10H16

IUPAC Name:

2,2-dimethyl-3-methylenebicyclo[2.2.1]heptane

Constituent 7

Reference substance name:

Linalool

EC Number:

201-134-4

EC Name:

Linalool

CAS Number:

78-70-6

Molecular formula:

C10H18O

IUPAC Name:

3,7-dimethylocta-1,6-dien-3-ol

Constituent 8

Reference substance name:

Caryophyllene

EC Number:

201-746-1

EC Name:

Caryophyllene

CAS Number:

87-44-5

Molecular formula:

C15H24

IUPAC Name:

4,11,11-trimethyl-8-methylenebicyclo[7.2.0]undec-4-ene

Constituent 9

Reference substance name:

Thuj-4(10)-ene

EC Number:

222-212-4

EC Name:

Thuj-4(10)-ene

CAS Number:

3387-41-5

Molecular formula:

C10H16

IUPAC Name:

Bicyclo(3.1.0)hexane, 4-methylene-1-(1-methylethyl)

Constituent 10

Reference substance name:

7-methyl-3-methyleneocta-1,6-diene

EC Number:

204-622-5

EC Name:

7-methyl-3-methyleneocta-1,6-diene

CAS Number:

123-35-3

Molecular formula:

C10H16

IUPAC Name:

7-methyl-3-methylideneocta-1,6-diene

Constituent 11

Reference substance name:

Mixture of (3Z)-3,7-dimethylocta-1,3,6-triene and (3E)-3,7-dimethylocta-1,3,6-triene

Molecular formula:

(3Z)-3,7-dimethylocta-1,3,6-triene: C10H16 (3E)-3,7-dimethylocta-1,3,6-triene: C10H16

IUPAC Name:

Mixture of (3Z)-3,7-dimethylocta-1,3,6-triene and (3E)-3,7-dimethylocta-1,3,6-triene

Constituent 12

Reference substance name:

Isopulegol

EC Number:

201-940-6

EC Name:

Isopulegol

CAS Number:

89-79-2

Molecular formula:

C10H18O

IUPAC Name:

2-isopropenyl-5-methylcyclohexanol

Constituent 13

Reference substance name:

Cyclohexanol, 5-methyl-2-(1-methylethenyl)-, (1S,2R,5R)-

CAS Number:

96612-21-4

Molecular formula:

C10H18O

IUPAC Name:

Cyclohexanol, 5-methyl-2-(1-methylethenyl)-, (1S,2R,5R)-

Constituent 14

Reference substance name:

Citronellyl acetate

EC Number:

205-775-0

EC Name:

Citronellyl acetate

CAS Number:

150-84-5

Molecular formula:

C12H22O2

IUPAC Name:

3,7-dimethyloct-6-en-1-yl acetate

Constituent 15

Reference substance name:

Mixture of 4,7-dimethyl-1-propan-2-yl-1,2,3,5,6,8a-hexahydronaphthalene (CAS 483-76-1), (1R,4aS,8aS)-7-methyl-4-methylidene-1-propan-2-yl-2,3,4a,5,6,8a-hexahydro-1H-naphthalene (CAS 39029-41-9) and (1S,4aR,8aR)-4,7-dimethyl-1-(propan-2-yl)-1,2,4a,5,6,8a-hexahydronaphthalene (CAS 24406-05-1)

Molecular formula:

(1S,4aR,8aR)-4,7-dimethyl-1-(propan-2-yl)-1,2,4a,5,6,8a-hexahydronaphthalene: C15H24 (1R,4aS,8aS)-7-methyl-4-methylidene-1-propan-2-yl-2,3,4a,5,6,8a-hexahydro-1H-naphthalene: C15H24 4,7-dimethyl-1-propan-2-yl-1,2,3,5,6,8a-hexahydronaphthalene: C15H24

IUPAC Name:

Mixture of 4,7-dimethyl-1-propan-2-yl-1,2,3,5,6,8a-hexahydronaphthalene (CAS 483-76-1), (1R,4aS,8aS)-7-methyl-4-methylidene-1-propan-2-yl-2,3,4a,5,6,8a-hexahydro-1H-naphthalene (CAS 39029-41-9) and (1S,4aR,8aR)-4,7-dimethyl-1-(propan-2-yl)-1,2,4a,5,6,8a-hexahydronaphthalene (CAS 24406-05-1)

Constituent 16

Reference substance name:

Terpineol

EC Number:

232-268-1

EC Name:

Terpineol

CAS Number:

8000-41-7

Molecular formula:

C10H18O

IUPAC Name:

2-(4-methylcyclohex-3-en-1-yl)propan-2-ol

Constituent 17

Reference substance name:

DL-borneol

EC Number:

208-080-0

EC Name:

DL-borneol

CAS Number:

507-70-0

Molecular formula:

C10H18O

IUPAC Name:

1,7,7-trimethylbicyclo[2.2.1]heptan-2-ol

Constituent 18

Reference substance name:

Pin-2(3)-ene

EC Number:

201-291-9

EC Name:

Pin-2(3)-ene

CAS Number:

80-56-8

Molecular formula:

C10H16

IUPAC Name:

4,7,7-trimethylbicyclo[3.1.1]hept-3-ene

Constituent 19

Reference substance name:

(1S,2R,4S)-1-ethenyl-1-methyl-2,4-bis(prop-1-en-2-yl)cyclohexane

CAS Number:

515-13-9

Molecular formula:

C15H24

IUPAC Name:

(1S,2R,4S)-1-ethenyl-1-methyl-2,4-bis(prop-1-en-2-yl)cyclohexane

Constituent 20

Reference substance name:

(1S,2S,4R)-(-)-α,α-dimethyl-1-vinyl-o-menth-8-ene-4-methanol

EC Number:

211-360-5

EC Name:

(1S,2S,4R)-(-)-α,α-dimethyl-1-vinyl-o-menth-8-ene-4-methanol

CAS Number:

639-99-6

Molecular formula:

C15H26O

IUPAC Name:

2-(3-isopropenyl-4-methyl-4-vinylcyclohexyl)propan-2-ol

Constituent 21

Reference substance name:

(1E,6E)-1-methyl-5-methylidene-8-propan-2-ylcyclodeca-1,6-diene

CAS Number:

23986-74-5

Molecular formula:

C15H24

IUPAC Name:

(1E,6E)-1-methyl-5-methylidene-8-propan-2-ylcyclodeca-1,6-diene

Constituent 22

Reference substance name:

Eugenol

EC Number:

202-589-1

EC Name:

Eugenol

CAS Number:

97-53-0

Molecular formula:

C10H12O2

IUPAC Name:

4-allyl-2-methoxyphenol

Constituent 23

Reference substance name:

(E)-3,7-dimethylocta-2,6-dienal

EC Number:

205-476-5

EC Name:

(E)-3,7-dimethylocta-2,6-dienal

CAS Number:

141-27-5

Molecular formula:

C10H16O

IUPAC Name:

(2E)-3,7-dimethylocta-2,6-dienal

Constituent 24

Reference substance name:

Mixture of (1S,4S,4aR,8aS)-1,6-dimethyl-4-propan-2-yl-3,4,4a,7,8,8a-hexahydro-2H-naphthalen-1-ol and (1R,4S,4aR,8aS)-1,6-dimethyl-4-propan-2-yl-3,4,4a,7,8,8a-hexahydro-2H-naphthalen-1-ol

Molecular formula:

(1S,4S,4aR,8aS)-1,6-dimethyl-4-propan-2-yl-3,4,4a,7,8,8a-hexahydro-2H-naphthalen-1-ol: C15H26O (1R,4S,4aR,8aS)-1,6-dimethyl-4-propan-2-yl-3,4,4a,7,8,8a-hexahydro-2H-naphthalen-1-ol: C15H26O

IUPAC Name:

Mixture of (1S,4S,4aR,8aS)-1,6-dimethyl-4-propan-2-yl-3,4,4a,7,8,8a-hexahydro-2H-naphthalen-1-ol and (1R,4S,4aR,8aS)-1,6-dimethyl-4-propan-2-yl-3,4,4a,7,8,8a-hexahydro-2H-naphthalen-1-ol

Constituent 25

Reference substance name:

Nerol

EC Number:

203-378-7

EC Name:

Nerol

CAS Number:

106-25-2

Molecular formula:

C10H18O

IUPAC Name:

2,6-Octadien-1-ol, 3,7-dimethyl-, (2Z)-

Constituent 26

Reference substance name:

p-mentha-1,4(8)-diene

EC Number:

209-578-0

EC Name:

p-mentha-1,4(8)-diene

CAS Number:

586-62-9

Molecular formula:

C10H16

IUPAC Name:

4-isopropylidene-1-methylcyclohexene

Constituent 27

Reference substance name:

Decanal

EC Number:

203-957-4

EC Name:

Decanal

CAS Number:

112-31-2

Molecular formula:

C10H20O

IUPAC Name:

1-decyl aldehyde

Constituent 28

Reference substance name:

Farnesol

EC Number:

225-004-1

EC Name:

Farnesol

CAS Number:

4602-84-0

Molecular formula:

C15H26O

IUPAC Name:

3,7,11-trimethyldodeca-2,6,10-trien-1-ol

Constituent 29

Reference substance name:

p-mentha-1(7),2-diene

EC Number:

209-081-9

EC Name:

p-mentha-1(7),2-diene

CAS Number:

555-10-2

Molecular formula:

C10H16

IUPAC Name:

3-methylidene-6-propan-2-ylcyclohexene

Constituent 30

Reference substance name:

Neryl acetate

EC Number:

205-459-2

EC Name:

Neryl acetate

CAS Number:

141-12-8

Molecular formula:

C12H20O2

IUPAC Name:

2,6-Octadien-1-ol, 3,7-dimethyl-, 1-acetate, (2Z)-

Constituent 31

Reference substance name:

p-cymene

EC Number:

202-796-7

EC Name:

p-cymene

CAS Number:

99-87-6

Molecular formula:

C10H14

IUPAC Name:

1-isopropyl-4-methylbenzene

Constituent 32

Reference substance name:

Unknown and other minor constituents in Cymbopogon winterianus extracts

IUPAC Name:

Unknown and other minor constituents in Cymbopogon winterianus extracts

Cymbopogon winterianus, ext.

State Form:

liquid

Constituent 1

Reference substance name:

(R)-3,7-dimethyloct-6-enal

EC Number:

219-194-5

EC Name:

(R)-3,7-dimethyloct-6-enal

CAS Number:

2385-77-5

Molecular formula:

C10H18O

IUPAC Name:

3,7-dimethyloct-6-enal

Constituent 2

Reference substance name:

Geraniol

EC Number:

203-377-1

EC Name:

Geraniol

CAS Number:

106-24-1

Molecular formula:

C10H18O

IUPAC Name:

(2E)-3,7-dimethylocta-2,6-dien-1-ol

Constituent 3

Reference substance name:

Citronellol

EC Number:

203-375-0

EC Name:

Citronellol

CAS Number:

106-22-9

Molecular formula:

C10H20O

IUPAC Name:

3,7-dimethyloct-6-en-1-ol

Constituent 4

Reference substance name:

Geranyl acetate

EC Number:

203-341-5

EC Name:

Geranyl acetate

CAS Number:

105-87-3

Molecular formula:

C12H20O2

IUPAC Name:

2,6-Octadien-1-ol, 3,7-dimethyl-, 1-acetate, (2E)-

Constituent 5

Reference substance name:

Citronellyl acetate

EC Number:

205-775-0

EC Name:

Citronellyl acetate

CAS Number:

150-84-5

Molecular formula:

C12H22O2

IUPAC Name:

3,7-dimethyloct-6-en-1-yl acetate

Constituent 6

Reference substance name:

(R)-p-mentha-1,8-diene

EC Number:

227-813-5

EC Name:

(R)-p-mentha-1,8-diene

CAS Number:

5989-27-5

Molecular formula:

C10H16

IUPAC Name:

(4R)-1-methyl-4-(prop-1-en-2-yl)cyclohexene

Constituent 7

Reference substance name:

1H-Cyclopenta(1,3)cyclopropa(1,2)benzene, octahydro-7-methyl-3-methylene-4-(1-methylethyl)-, (3aS-(3aalpha,3bbata,4beta,7alpha,7aS*))-

CAS Number:

13744-15-5

Molecular formula:

C15H24

IUPAC Name:

1H-Cyclopenta(1,3)cyclopropa(1,2)benzene, octahydro-7-methyl-3-methylene-4-(1-methylethyl)-, (3aS-(3aalpha,3bbata,4beta,7alpha,7aS*))-

Constituent 8

Reference substance name:

(1S,2S,4R)-(-)-α,α-dimethyl-1-vinyl-o-menth-8-ene-4-methanol

EC Number:

211-360-5

EC Name:

(1S,2S,4R)-(-)-α,α-dimethyl-1-vinyl-o-menth-8-ene-4-methanol

CAS Number:

639-99-6

Molecular formula:

C15H26O

IUPAC Name:

2-(3-isopropenyl-4-methyl-4-vinylcyclohexyl)propan-2-ol

Constituent 9

Reference substance name:

(Z)-3,7-dimethylocta-2,6-dienal

EC Number:

203-379-2

EC Name:

(Z)-3,7-dimethylocta-2,6-dienal

CAS Number:

106-26-3

Molecular formula:

C10H16O

IUPAC Name:

3,7-dimethylocta-2,6-dienal

Constituent 10

Reference substance name:

1-Naphthalenol, 1,2,3,4,4a,7,8,8a-octahydro-1,6-dimethyl-4-(1-methylethyl)-, (1S-(1alpha,4alpha,4aalpha,8aalpha))-

CAS Number:

19912-62-0 / 19435-97-3

Molecular formula:

C15H26O

IUPAC Name:

1-Naphthalenol, 1,2,3,4,4a,7,8,8a-octahydro-1,6-dimethyl-4-(1-methylethyl)-, (1S-(1alpha,4alpha,4aalpha,8aalpha))-

Citronella Oil TOGO

State Form:

liquid

Constituent 1

Reference substance name:

(R)-p-mentha-1,8-diene

EC Number:

227-813-5

EC Name:

(R)-p-mentha-1,8-diene

CAS Number:

5989-27-5

Molecular formula:

C10H16

IUPAC Name:

(4R)-1-methyl-4-(prop-1-en-2-yl)cyclohexene

Constituent 2

Reference substance name:

(R)-3,7-dimethyloct-6-enal

EC Number:

219-194-5

EC Name:

(R)-3,7-dimethyloct-6-enal

CAS Number:

2385-77-5

Molecular formula:

C10H18O

IUPAC Name:

3,7-dimethyloct-6-enal

Constituent 3

Reference substance name:

Geraniol

EC Number:

203-377-1

EC Name:

Geraniol

CAS Number:

106-24-1

Molecular formula:

C10H18O

IUPAC Name:

(2E)-3,7-dimethylocta-2,6-dien-1-ol

Constituent 4

Reference substance name:

Citronellol

EC Number:

203-375-0

EC Name:

Citronellol

CAS Number:

106-22-9

Molecular formula:

C10H20O

IUPAC Name:

3,7-dimethyloct-6-en-1-ol

Constituent 5

Reference substance name:

Geranyl acetate

EC Number:

203-341-5

EC Name:

Geranyl acetate

CAS Number:

105-87-3

Molecular formula:

C12H20O2

IUPAC Name:

2,6-Octadien-1-ol, 3,7-dimethyl-, 1-acetate, (2E)-

Constituent 6

Reference substance name:

Linalool

EC Number:

201-134-4

EC Name:

Linalool

CAS Number:

78-70-6

Molecular formula:

C10H18O

IUPAC Name:

3,7-dimethylocta-1,6-dien-3-ol

Constituent 7

Reference substance name:

Citronellyl acetate

EC Number:

205-775-0

EC Name:

Citronellyl acetate

CAS Number:

150-84-5

Molecular formula:

C12H22O2

IUPAC Name:

3,7-dimethyloct-6-en-1-yl acetate

Constituent 8

Reference substance name:

(1R,8aS)‐1‐isopropyl‐4,7‐dimethyl‐1,2,3,5,6,8ahexahydronaphthalene

CAS Number:

483-76-1

Molecular formula:

C15H24

IUPAC Name:

(1R,8aS)‐1‐isopropyl‐4,7‐dimethyl‐1,2,3,5,6,8ahexahydronaphthalene

Constituent 9

Reference substance name:

(1α,2β,4β)-1-methyl-2,4-bis(methylvinyl)-1-vinylcyclohexane

EC Number:

251-713-0

EC Name:

(1α,2β,4β)-1-methyl-2,4-bis(methylvinyl)-1-vinylcyclohexane

CAS Number:

33880-83-0

Molecular formula:

C15H24

IUPAC Name:

rel-(1R,2R,4S)-1-methyl-2,4-di(prop-1-en-2-yl)-1-vinylcyclohexane

Constituent 10

Reference substance name:

(1S,2S,4R)-(-)-α,α-dimethyl-1-vinyl-o-menth-8-ene-4-methanol

EC Number:

211-360-5

EC Name:

(1S,2S,4R)-(-)-α,α-dimethyl-1-vinyl-o-menth-8-ene-4-methanol

CAS Number:

639-99-6

Molecular formula:

C15H26O

IUPAC Name:

2-(3-isopropenyl-4-methyl-4-vinylcyclohexyl)propan-2-ol

Constituent 11

Reference substance name:

(6E,8S)‐1‐methyl‐5‐methylidene‐8‐(propan‐2‐yl)cyclodeca‐1,6‐diene

CAS Number:

23986-74-5

Molecular formula:

C15H24

IUPAC Name:

(6E,8S)‐1‐methyl‐5‐methylidene‐8‐(propan‐2‐yl)cyclodeca‐1,6‐diene

Constituent 12

Reference substance name:

Undetermined minor constituents in Citronella Oil TOGO

Molecular formula:

Not applicable

IUPAC Name:

Undetermined minor constituents in Citronella Oil TOGO

Citronella

State Form:

liquid

Constituent 1

Reference substance name:

(R)-p-mentha-1,8-diene

EC Number:

227-813-5

EC Name:

(R)-p-mentha-1,8-diene

CAS Number:

5989-27-5

Molecular formula:

C10H16

IUPAC Name:

(4R)-1-methyl-4-(prop-1-en-2-yl)cyclohexene

Constituent 2

Reference substance name:

(R)-3,7-dimethyloct-6-enal

EC Number:

219-194-5

EC Name:

(R)-3,7-dimethyloct-6-enal

CAS Number:

2385-77-5

Molecular formula:

C10H18O

IUPAC Name:

3,7-dimethyloct-6-enal

Constituent 3

Reference substance name:

Citronellyl acetate

EC Number:

205-775-0

EC Name:

Citronellyl acetate

CAS Number:

150-84-5

Molecular formula:

C12H22O2

IUPAC Name:

3,7-dimethyloct-6-en-1-yl acetate

Constituent 4

Reference substance name:

(1Z,6Z)-1-methyl-5-methylidene-8-(propan-2-yl)cyclodeca-1,6-diene

CAS Number:

37839-63-7

Molecular formula:

C15H24

IUPAC Name:

(1Z,6Z)-1-methyl-5-methylidene-8-(propan-2-yl)cyclodeca-1,6-diene

Constituent 5

Reference substance name:

4,7-dimethyl-1-propan-2-yl-1,2,3,5,6,8a-hexahydronaphthalene

CAS Number:

483-76-1

Molecular formula:

C15-H24

IUPAC Name:

4,7-dimethyl-1-propan-2-yl-1,2,3,5,6,8a-hexahydronaphthalene

Constituent 6

Reference substance name:

Geranyl acetate

EC Number:

203-341-5

EC Name:

Geranyl acetate

CAS Number:

105-87-3

Molecular formula:

C12H20O2

IUPAC Name:

2,6-Octadien-1-ol, 3,7-dimethyl-, 1-acetate, (2E)-

Constituent 7

Reference substance name:

Citronellol

EC Number:

203-375-0

EC Name:

Citronellol

CAS Number:

106-22-9

Molecular formula:

C10H20O

IUPAC Name:

3,7-dimethyloct-6-en-1-ol

Constituent 8

Reference substance name:

Geraniol

EC Number:

203-377-1

EC Name:

Geraniol

CAS Number:

106-24-1

Molecular formula:

C10H18O

IUPAC Name:

(2E)-3,7-dimethylocta-2,6-dien-1-ol

Constituent 9

Reference substance name:

(1S,2S,4R)-(-)-α,α-dimethyl-1-vinyl-o-menth-8-ene-4-methanol

EC Number:

211-360-5

EC Name:

(1S,2S,4R)-(-)-α,α-dimethyl-1-vinyl-o-menth-8-ene-4-methanol

CAS Number:

639-99-6

Molecular formula:

C15H26O

IUPAC Name:

2-(3-isopropenyl-4-methyl-4-vinylcyclohexyl)propan-2-ol

Constituent 10

Reference substance name:

Eugenol

EC Number:

202-589-1

EC Name:

Eugenol

CAS Number:

97-53-0

Molecular formula:

C10H12O2

IUPAC Name:

4-allyl-2-methoxyphenol

Constituent 11

Reference substance name:

(1R,4S,4aR,8aS)-1,6-dimethyl-4-propan-2-yl-3,4,4a,7,8,8a-hexahydro-2H-naphthalen-1-ol

CAS Number:

19435-97-3

Molecular formula:

C15 H26 O

IUPAC Name:

(1R,4S,4aR,8aS)-1,6-dimethyl-4-propan-2-yl-3,4,4a,7,8,8a-hexahydro-2H-naphthalen-1-ol

Constituent 12

Reference substance name:

Unknown constituents

Molecular formula:

not applicable: unknown UVCB constituents

IUPAC Name:

Unknown constituents

Cymbopogon winterianus, ext.

State Form:

liquid

Constituent 1

Reference substance name:

(R)-p-mentha-1,8-diene

EC Number:

227-813-5

EC Name:

(R)-p-mentha-1,8-diene

CAS Number:

5989-27-5

Molecular formula:

C10H16

IUPAC Name:

(4R)-1-methyl-4-(prop-1-en-2-yl)cyclohexene

Constituent 2

Reference substance name:

(R)-3,7-dimethyloct-6-enal

EC Number:

219-194-5

EC Name:

(R)-3,7-dimethyloct-6-enal

CAS Number:

2385-77-5

Molecular formula:

C10H18O

IUPAC Name:

3,7-dimethyloct-6-enal

Constituent 3

Reference substance name:

Citronellol

EC Number:

203-375-0

EC Name:

Citronellol

CAS Number:

106-22-9

Molecular formula:

C10H20O

IUPAC Name:

3,7-dimethyloct-6-en-1-ol

Constituent 4

Reference substance name:

Geraniol

EC Number:

203-377-1

EC Name:

Geraniol

CAS Number:

106-24-1

Molecular formula:

C10H18O

IUPAC Name:

(2E)-3,7-dimethylocta-2,6-dien-1-ol

Constituent 5

Reference substance name:

Citronellyl acetate

EC Number:

205-775-0

EC Name:

Citronellyl acetate

CAS Number:

150-84-5

Molecular formula:

C12H22O2

IUPAC Name:

3,7-dimethyloct-6-en-1-yl acetate

Constituent 6

Reference substance name:

Geranyl acetate

EC Number:

203-341-5

EC Name:

Geranyl acetate

CAS Number:

105-87-3

Molecular formula:

C12H20O2

IUPAC Name:

2,6-Octadien-1-ol, 3,7-dimethyl-, 1-acetate, (2E)-

Constituent 7

Reference substance name:

1-methyl-2,4-di(prop-1-en-2-yl)-1-vinylcyclohexane

CAS Number:

515-13-9

Molecular formula:

C15-H24

IUPAC Name:

1-methyl-2,4-di(prop-1-en-2-yl)-1-vinylcyclohexane

Constituent 8

Reference substance name:

1,6-Cyclodecadiene, 1-methyl-5-methylene-8-(1-methylethyl)-, (S-(E,E))-

CAS Number:

23986-74-5

Molecular formula:

C15-H24

IUPAC Name:

1,6-Cyclodecadiene, 1-methyl-5-methylene-8-(1-methylethyl)-, (S-(E,E))-

Constituent 9

Reference substance name:

C15 H24, Naphthalene, 1,2,3,4,4a,5,6,8a-octahydro-7-methyl-4-methylene-1-(1-methylethyl)-

CAS Number:

39029-41-9

Molecular formula:

C15H24

IUPAC Name:

C15 H24, Naphthalene, 1,2,3,4,4a,5,6,8a-octahydro-7-methyl-4-methylene-1-(1-methylethyl)-

Constituent 10

Reference substance name:

(1S,2S,4R)-(-)-α,α-dimethyl-1-vinyl-o-menth-8-ene-4-methanol

EC Number:

211-360-5

EC Name:

(1S,2S,4R)-(-)-α,α-dimethyl-1-vinyl-o-menth-8-ene-4-methanol

CAS Number:

639-99-6

Molecular formula:

C15H26O

IUPAC Name:

2-(3-isopropenyl-4-methyl-4-vinylcyclohexyl)propan-2-ol

Cymbopogon winterianus, ext.

State Form:

liquid

Constituent 1

Reference substance name:

(R)-p-mentha-1,8-diene

EC Number:

227-813-5

EC Name:

(R)-p-mentha-1,8-diene

CAS Number:

5989-27-5

Molecular formula:

C10H16

IUPAC Name:

(4R)-1-methyl-4-(prop-1-en-2-yl)cyclohexene

Constituent 2

Reference substance name:

(R)-3,7-dimethyloct-6-enal

EC Number:

219-194-5

EC Name:

(R)-3,7-dimethyloct-6-enal

CAS Number:

2385-77-5

Molecular formula:

C10H18O

IUPAC Name:

3,7-dimethyloct-6-enal

Constituent 3

Reference substance name:

Citronellol

EC Number:

203-375-0

EC Name:

Citronellol

CAS Number:

106-22-9

Molecular formula:

C10H20O

IUPAC Name:

3,7-dimethyloct-6-en-1-ol

Constituent 4

Reference substance name:

Geraniol

EC Number:

203-377-1

EC Name:

Geraniol

CAS Number:

106-24-1

Molecular formula:

C10H18O

IUPAC Name:

(2E)-3,7-dimethylocta-2,6-dien-1-ol

Constituent 5

Reference substance name:

Citronellyl acetate

EC Number:

205-775-0

EC Name:

Citronellyl acetate

CAS Number:

150-84-5

Molecular formula:

C12H22O2

IUPAC Name:

3,7-dimethyloct-6-en-1-yl acetate

Constituent 6

Reference substance name:

Eugenol

EC Number:

202-589-1

EC Name:

Eugenol

CAS Number:

97-53-0

Molecular formula:

C10H12O2

IUPAC Name:

4-allyl-2-methoxyphenol

Constituent 7

Reference substance name:

Geranyl acetate

EC Number:

203-341-5

EC Name:

Geranyl acetate

CAS Number:

105-87-3

Molecular formula:

C12H20O2

IUPAC Name:

2,6-Octadien-1-ol, 3,7-dimethyl-, 1-acetate, (2E)-

Constituent 8

Reference substance name:

1-methyl-2,4-di(prop-1-en-2-yl)-1-vinylcyclohexane

CAS Number:

515-13-9

Molecular formula:

C15-H24

IUPAC Name:

1-methyl-2,4-di(prop-1-en-2-yl)-1-vinylcyclohexane

Constituent 9

Reference substance name:

1,6-Cyclodecadiene, 1-methyl-5-methylene-8-(1-methylethyl)-, (S-(E,E))-

CAS Number:

23986-74-5

Molecular formula:

C15-H24

IUPAC Name:

1,6-Cyclodecadiene, 1-methyl-5-methylene-8-(1-methylethyl)-, (S-(E,E))-

Constituent 10

Reference substance name:

C15 H24, Naphthalene, 1,2,3,4,4a,5,6,8a-octahydro-7-methyl-4-methylene-1-(1-methylethyl)-

CAS Number:

39029-41-9

Molecular formula:

C15H24

IUPAC Name:

C15 H24, Naphthalene, 1,2,3,4,4a,5,6,8a-octahydro-7-methyl-4-methylene-1-(1-methylethyl)-

Constituent 11

Reference substance name:

(1S,2S,4R)-(-)-α,α-dimethyl-1-vinyl-o-menth-8-ene-4-methanol

EC Number:

211-360-5

EC Name:

(1S,2S,4R)-(-)-α,α-dimethyl-1-vinyl-o-menth-8-ene-4-methanol

CAS Number:

639-99-6

Molecular formula:

C15H26O

IUPAC Name:

2-(3-isopropenyl-4-methyl-4-vinylcyclohexyl)propan-2-ol

Citronella Oil obtained from the leaves of Cymbopogon winterianus, Gramineae by distillation

State Form:

liquid

Constituent 1

Reference substance name:

(R)-p-mentha-1,8-diene

EC Number:

227-813-5

EC Name:

(R)-p-mentha-1,8-diene

CAS Number:

5989-27-5

Molecular formula:

C10H16

IUPAC Name:

(4R)-1-methyl-4-(prop-1-en-2-yl)cyclohexene

Constituent 2

Reference substance name:

(R)-3,7-dimethyloct-6-enal

EC Number:

219-194-5

EC Name:

(R)-3,7-dimethyloct-6-enal

CAS Number:

2385-77-5

Molecular formula:

C10H18O

IUPAC Name:

3,7-dimethyloct-6-enal

Constituent 3

Reference substance name:

Geraniol

EC Number:

203-377-1

EC Name:

Geraniol

CAS Number:

106-24-1

Molecular formula:

C10H18O

IUPAC Name:

(2E)-3,7-dimethylocta-2,6-dien-1-ol

Constituent 4

Reference substance name:

Citronellol

EC Number:

203-375-0

EC Name:

Citronellol

CAS Number:

106-22-9

Molecular formula:

C10H20O

IUPAC Name:

3,7-dimethyloct-6-en-1-ol

Constituent 5

Reference substance name:

Geranyl acetate

EC Number:

203-341-5

EC Name:

Geranyl acetate

CAS Number:

105-87-3

Molecular formula:

C12H20O2

IUPAC Name:

2,6-Octadien-1-ol, 3,7-dimethyl-, 1-acetate, (2E)-

Constituent 6

Reference substance name:

Camphene

EC Number:

201-234-8

EC Name:

Camphene

CAS Number:

79-92-5

Molecular formula:

C10H16

IUPAC Name:

2,2-dimethyl-3-methylenebicyclo[2.2.1]heptane

Constituent 7

Reference substance name:

Linalool

EC Number:

201-134-4

EC Name:

Linalool

CAS Number:

78-70-6

Molecular formula:

C10H18O

IUPAC Name:

3,7-dimethylocta-1,6-dien-3-ol

Constituent 8

Reference substance name:

Caryophyllene

EC Number:

201-746-1

EC Name:

Caryophyllene

CAS Number:

87-44-5

Molecular formula:

C15H24

IUPAC Name:

4,11,11-trimethyl-8-methylenebicyclo[7.2.0]undec-4-ene

Constituent 9

Reference substance name:

Thuj-4(10)-ene

EC Number:

222-212-4

EC Name:

Thuj-4(10)-ene

CAS Number:

3387-41-5

Molecular formula:

C10H16

IUPAC Name:

Bicyclo(3.1.0)hexane, 4-methylene-1-(1-methylethyl)

Constituent 10

Reference substance name:

7-methyl-3-methyleneocta-1,6-diene

EC Number:

204-622-5

EC Name:

7-methyl-3-methyleneocta-1,6-diene

CAS Number:

123-35-3

Molecular formula:

C10H16

IUPAC Name:

7-methyl-3-methylideneocta-1,6-diene

Constituent 11

Reference substance name:

Mixture of (3Z)-3,7-dimethylocta-1,3,6-triene and (3E)-3,7-dimethylocta-1,3,6-triene

Molecular formula:

(3Z)-3,7-dimethylocta-1,3,6-triene: C10H16 (3E)-3,7-dimethylocta-1,3,6-triene: C10H16

IUPAC Name:

Mixture of (3Z)-3,7-dimethylocta-1,3,6-triene and (3E)-3,7-dimethylocta-1,3,6-triene

Constituent 12

Reference substance name:

Isopulegol

EC Number:

201-940-6

EC Name:

Isopulegol

CAS Number:

89-79-2

Molecular formula:

C10H18O

IUPAC Name:

2-isopropenyl-5-methylcyclohexanol

Constituent 13

Reference substance name:

Cyclohexanol, 5-methyl-2-(1-methylethenyl)-, (1S,2R,5R)-

CAS Number:

96612-21-4

Molecular formula:

C10H18O

IUPAC Name:

Cyclohexanol, 5-methyl-2-(1-methylethenyl)-, (1S,2R,5R)-

Constituent 14

Reference substance name:

Citronellyl acetate

EC Number:

205-775-0

EC Name:

Citronellyl acetate

CAS Number:

150-84-5

Molecular formula:

C12H22O2

IUPAC Name:

3,7-dimethyloct-6-en-1-yl acetate

Constituent 15

Reference substance name:

Mixture of 4,7-dimethyl-1-propan-2-yl-1,2,3,5,6,8a-hexahydronaphthalene (CAS 483-76-1), (1R,4aS,8aS)-7-methyl-4-methylidene-1-propan-2-yl-2,3,4a,5,6,8a-hexahydro-1H-naphthalene (CAS 39029-41-9) and (1S,4aR,8aR)-4,7-dimethyl-1-(propan-2-yl)-1,2,4a,5,6,8a-hexahydronaphthalene (CAS 24406-05-1)

Molecular formula:

(1S,4aR,8aR)-4,7-dimethyl-1-(propan-2-yl)-1,2,4a,5,6,8a-hexahydronaphthalene: C15H24 (1R,4aS,8aS)-7-methyl-4-methylidene-1-propan-2-yl-2,3,4a,5,6,8a-hexahydro-1H-naphthalene: C15H24 4,7-dimethyl-1-propan-2-yl-1,2,3,5,6,8a-hexahydronaphthalene: C15H24

IUPAC Name:

Mixture of 4,7-dimethyl-1-propan-2-yl-1,2,3,5,6,8a-hexahydronaphthalene (CAS 483-76-1), (1R,4aS,8aS)-7-methyl-4-methylidene-1-propan-2-yl-2,3,4a,5,6,8a-hexahydro-1H-naphthalene (CAS 39029-41-9) and (1S,4aR,8aR)-4,7-dimethyl-1-(propan-2-yl)-1,2,4a,5,6,8a-hexahydronaphthalene (CAS 24406-05-1)

Constituent 16

Reference substance name:

Terpineol

EC Number:

232-268-1

EC Name:

Terpineol

CAS Number:

8000-41-7

Molecular formula:

C10H18O

IUPAC Name:

2-(4-methylcyclohex-3-en-1-yl)propan-2-ol

Constituent 17

Reference substance name:

DL-borneol

EC Number:

208-080-0

EC Name:

DL-borneol

CAS Number:

507-70-0

Molecular formula:

C10H18O

IUPAC Name:

1,7,7-trimethylbicyclo[2.2.1]heptan-2-ol

Constituent 18

Reference substance name:

Pin-2(3)-ene

EC Number:

201-291-9

EC Name:

Pin-2(3)-ene

CAS Number:

80-56-8

Molecular formula:

C10H16

IUPAC Name:

4,7,7-trimethylbicyclo[3.1.1]hept-3-ene

Constituent 19

Reference substance name:

(1S,2R,4S)-1-ethenyl-1-methyl-2,4-bis(prop-1-en-2-yl)cyclohexane

CAS Number:

515-13-9

Molecular formula:

C15H24

IUPAC Name:

(1S,2R,4S)-1-ethenyl-1-methyl-2,4-bis(prop-1-en-2-yl)cyclohexane

Constituent 20

Reference substance name:

(1S,2S,4R)-(-)-α,α-dimethyl-1-vinyl-o-menth-8-ene-4-methanol

EC Number:

211-360-5

EC Name:

(1S,2S,4R)-(-)-α,α-dimethyl-1-vinyl-o-menth-8-ene-4-methanol

CAS Number:

639-99-6

Molecular formula:

C15H26O

IUPAC Name:

2-(3-isopropenyl-4-methyl-4-vinylcyclohexyl)propan-2-ol

Constituent 21

Reference substance name:

(1E,6E)-1-methyl-5-methylidene-8-propan-2-ylcyclodeca-1,6-diene

CAS Number:

23986-74-5

Molecular formula:

C15H24

IUPAC Name:

(1E,6E)-1-methyl-5-methylidene-8-propan-2-ylcyclodeca-1,6-diene

Constituent 22

Reference substance name:

Eugenol

EC Number:

202-589-1

EC Name:

Eugenol

CAS Number:

97-53-0

Molecular formula:

C10H12O2

IUPAC Name:

4-allyl-2-methoxyphenol

Constituent 23

Reference substance name:

(E)-3,7-dimethylocta-2,6-dienal

EC Number:

205-476-5

EC Name:

(E)-3,7-dimethylocta-2,6-dienal

CAS Number:

141-27-5

Molecular formula:

C10H16O

IUPAC Name:

(2E)-3,7-dimethylocta-2,6-dienal

Constituent 24

Reference substance name:

Mixture of (1S,4S,4aR,8aS)-1,6-dimethyl-4-propan-2-yl-3,4,4a,7,8,8a-hexahydro-2H-naphthalen-1-ol and (1R,4S,4aR,8aS)-1,6-dimethyl-4-propan-2-yl-3,4,4a,7,8,8a-hexahydro-2H-naphthalen-1-ol

Molecular formula:

(1S,4S,4aR,8aS)-1,6-dimethyl-4-propan-2-yl-3,4,4a,7,8,8a-hexahydro-2H-naphthalen-1-ol: C15H26O (1R,4S,4aR,8aS)-1,6-dimethyl-4-propan-2-yl-3,4,4a,7,8,8a-hexahydro-2H-naphthalen-1-ol: C15H26O

IUPAC Name:

Mixture of (1S,4S,4aR,8aS)-1,6-dimethyl-4-propan-2-yl-3,4,4a,7,8,8a-hexahydro-2H-naphthalen-1-ol and (1R,4S,4aR,8aS)-1,6-dimethyl-4-propan-2-yl-3,4,4a,7,8,8a-hexahydro-2H-naphthalen-1-ol

Constituent 25

Reference substance name:

Nerol

EC Number:

203-378-7

EC Name:

Nerol

CAS Number:

106-25-2

Molecular formula:

C10H18O

IUPAC Name:

2,6-Octadien-1-ol, 3,7-dimethyl-, (2Z)-

Constituent 26

Reference substance name:

p-mentha-1,4(8)-diene

EC Number:

209-578-0

EC Name:

p-mentha-1,4(8)-diene

CAS Number:

586-62-9

Molecular formula:

C10H16

IUPAC Name:

4-isopropylidene-1-methylcyclohexene

Constituent 27

Reference substance name:

Decanal

EC Number:

203-957-4

EC Name:

Decanal

CAS Number:

112-31-2

Molecular formula:

C10H20O

IUPAC Name:

1-decyl aldehyde

Constituent 28

Reference substance name:

Farnesol

EC Number:

225-004-1

EC Name:

Farnesol

CAS Number:

4602-84-0

Molecular formula:

C15H26O

IUPAC Name:

3,7,11-trimethyldodeca-2,6,10-trien-1-ol

Constituent 29

Reference substance name:

p-mentha-1(7),2-diene

EC Number:

209-081-9

EC Name:

p-mentha-1(7),2-diene

CAS Number:

555-10-2

Molecular formula:

C10H16

IUPAC Name:

3-methylidene-6-propan-2-ylcyclohexene

Constituent 30

Reference substance name:

Neryl acetate

EC Number:

205-459-2

EC Name:

Neryl acetate

CAS Number:

141-12-8

Molecular formula:

C12H20O2

IUPAC Name:

2,6-Octadien-1-ol, 3,7-dimethyl-, 1-acetate, (2Z)-

Constituent 31

Reference substance name:

p-cymene

EC Number:

202-796-7

EC Name:

p-cymene

CAS Number:

99-87-6

Molecular formula:

C10H14

IUPAC Name:

1-isopropyl-4-methylbenzene

Constituent 32

Reference substance name:

Unknown and other minor constituents in Cymbopogon winterianus extracts

IUPAC Name:

Unknown and other minor constituents in Cymbopogon winterianus extracts

Online dossier

State Form:

liquid

Constituent 1

Reference substance name:

(R)-p-mentha-1,8-diene

EC Number:

227-813-5

EC Name:

(R)-p-mentha-1,8-diene

CAS Number:

5989-27-5

Molecular formula:

C10H16

IUPAC Name:

(4R)-1-methyl-4-(prop-1-en-2-yl)cyclohexene

Constituent 2

Reference substance name:

(R)-3,7-dimethyloct-6-enal

EC Number:

219-194-5

EC Name:

(R)-3,7-dimethyloct-6-enal

CAS Number:

2385-77-5

Molecular formula:

C10H18O

IUPAC Name:

3,7-dimethyloct-6-enal

Constituent 3

Reference substance name:

Geraniol

EC Number:

203-377-1

EC Name:

Geraniol

CAS Number:

106-24-1

Molecular formula:

C10H18O

IUPAC Name:

(2E)-3,7-dimethylocta-2,6-dien-1-ol

Constituent 4

Reference substance name:

Citronellol

EC Number:

203-375-0

EC Name:

Citronellol

CAS Number:

106-22-9

Molecular formula:

C10H20O

IUPAC Name:

3,7-dimethyloct-6-en-1-ol

Constituent 5

Reference substance name:

Geranyl acetate

EC Number:

203-341-5

EC Name:

Geranyl acetate

CAS Number:

105-87-3

Molecular formula:

C12H20O2

IUPAC Name:

2,6-Octadien-1-ol, 3,7-dimethyl-, 1-acetate, (2E)-

Constituent 6

Reference substance name:

Camphene

EC Number:

201-234-8

EC Name:

Camphene

CAS Number:

79-92-5

Molecular formula:

C10H16

IUPAC Name:

2,2-dimethyl-3-methylenebicyclo[2.2.1]heptane

Constituent 7

Reference substance name:

Linalool

EC Number:

201-134-4

EC Name:

Linalool

CAS Number:

78-70-6

Molecular formula:

C10H18O

IUPAC Name:

3,7-dimethylocta-1,6-dien-3-ol

Constituent 8

Reference substance name:

Caryophyllene

EC Number:

201-746-1

EC Name:

Caryophyllene

CAS Number:

87-44-5

Molecular formula:

C15H24

IUPAC Name:

4,11,11-trimethyl-8-methylenebicyclo[7.2.0]undec-4-ene

Constituent 9

Reference substance name:

Thuj-4(10)-ene

EC Number:

222-212-4

EC Name:

Thuj-4(10)-ene

CAS Number:

3387-41-5

Molecular formula:

C10H16

IUPAC Name:

Bicyclo(3.1.0)hexane, 4-methylene-1-(1-methylethyl)

Constituent 10

Reference substance name:

7-methyl-3-methyleneocta-1,6-diene

EC Number:

204-622-5

EC Name:

7-methyl-3-methyleneocta-1,6-diene

CAS Number:

123-35-3

Molecular formula:

C10H16

IUPAC Name:

7-methyl-3-methylideneocta-1,6-diene

Constituent 11

Reference substance name:

(Z)-3,7-dimethylocta-1,3,6,-triene

EC Number:

222-081-3

EC Name:

(Z)-3,7-dimethylocta-1,3,6,-triene

CAS Number:

3338-55-4

Molecular formula:

C10H16

IUPAC Name:

3,7-dimethylocta-1,3,6-triene

Constituent 12

Reference substance name:

Isopulegol

EC Number:

201-940-6

EC Name:

Isopulegol

CAS Number:

89-79-2

Molecular formula:

C10H18O

IUPAC Name:

2-isopropenyl-5-methylcyclohexanol

Constituent 13

Reference substance name:

Citronellyl acetate

EC Number:

205-775-0

EC Name:

Citronellyl acetate

CAS Number:

150-84-5

Molecular formula:

C12H22O2

IUPAC Name:

3,7-dimethyloct-6-en-1-yl acetate

Constituent 14

Reference substance name:

Terpineol

EC Number:

232-268-1

EC Name:

Terpineol

CAS Number:

8000-41-7

Molecular formula:

C10H18O

IUPAC Name:

2-(4-methylcyclohex-3-en-1-yl)propan-2-ol

Constituent 15

Reference substance name:

DL-borneol

EC Number:

208-080-0

EC Name:

DL-borneol

CAS Number:

507-70-0

Molecular formula:

C10H18O

IUPAC Name:

1,7,7-trimethylbicyclo[2.2.1]heptan-2-ol

Constituent 16

Reference substance name:

Pin-2(3)-ene

EC Number:

201-291-9

EC Name:

Pin-2(3)-ene

CAS Number:

80-56-8

Molecular formula:

C10H16

IUPAC Name:

4,7,7-trimethylbicyclo[3.1.1]hept-3-ene

Constituent 17

Reference substance name:

(1S,2R,4S)-1-ethenyl-1-methyl-2,4-bis(prop-1-en-2-yl)cyclohexane

CAS Number:

515-13-9

Molecular formula:

C15H24

IUPAC Name:

(1S,2R,4S)-1-ethenyl-1-methyl-2,4-bis(prop-1-en-2-yl)cyclohexane

Constituent 18

Reference substance name:

(1S,2S,4R)-(-)-α,α-dimethyl-1-vinyl-o-menth-8-ene-4-methanol

EC Number:

211-360-5

EC Name:

(1S,2S,4R)-(-)-α,α-dimethyl-1-vinyl-o-menth-8-ene-4-methanol

CAS Number:

639-99-6

Molecular formula:

C15H26O

IUPAC Name:

2-(3-isopropenyl-4-methyl-4-vinylcyclohexyl)propan-2-ol

Constituent 19

Reference substance name:

(1E,6E)-1-methyl-5-methylidene-8-propan-2-ylcyclodeca-1,6-diene

CAS Number:

23986-74-5

Molecular formula:

C15H24

IUPAC Name:

(1E,6E)-1-methyl-5-methylidene-8-propan-2-ylcyclodeca-1,6-diene

Constituent 20

Reference substance name:

Nerol

EC Number:

203-378-7

EC Name:

Nerol

CAS Number:

106-25-2

Molecular formula:

C10H18O

IUPAC Name:

2,6-Octadien-1-ol, 3,7-dimethyl-, (2Z)-

Constituent 21

Reference substance name:

p-mentha-1,4(8)-diene

EC Number:

209-578-0

EC Name:

p-mentha-1,4(8)-diene

CAS Number:

586-62-9

Molecular formula:

C10H16

IUPAC Name:

4-isopropylidene-1-methylcyclohexene

Constituent 22

Reference substance name:

Decanal

EC Number:

203-957-4

EC Name:

Decanal

CAS Number:

112-31-2

Molecular formula:

C10H20O

IUPAC Name:

1-decyl aldehyde

Constituent 23

Reference substance name:

Farnesol

EC Number:

225-004-1

EC Name:

Farnesol

CAS Number:

4602-84-0

Molecular formula:

C15H26O

IUPAC Name:

3,7,11-trimethyldodeca-2,6,10-trien-1-ol

Constituent 24

Reference substance name:

p-mentha-1(7),2-diene

EC Number:

209-081-9

EC Name:

p-mentha-1(7),2-diene

CAS Number:

555-10-2

Molecular formula:

C10H16

IUPAC Name:

3-methylidene-6-propan-2-ylcyclohexene

Constituent 25

Reference substance name:

Neryl acetate

EC Number:

205-459-2

EC Name:

Neryl acetate

CAS Number:

141-12-8

Molecular formula:

C12H20O2

IUPAC Name:

2,6-Octadien-1-ol, 3,7-dimethyl-, 1-acetate, (2Z)-

Constituent 26

Reference substance name:

p-cymene

EC Number:

202-796-7

EC Name:

p-cymene

CAS Number:

99-87-6

Molecular formula:

C10H14

IUPAC Name:

1-isopropyl-4-methylbenzene

Constituent 27

Reference substance name:

Unknown constituents

IUPAC Name:

Unknown constituents

Constituent 28

Reference substance name:

(E)-3,7-dimethylocta-2,6-dienal

EC Number:

205-476-5

EC Name:

(E)-3,7-dimethylocta-2,6-dienal

CAS Number:

141-27-5

Molecular formula:

C10H16O

IUPAC Name:

(2E)-3,7-dimethylocta-2,6-dienal

Constituent 29

Reference substance name:

Mixture of (1S,4S,4aR,8aS)-1,6-dimethyl-4-propan-2-yl-3,4,4a,7,8,8a-hexahydro-2H-naphthalen-1-ol and (1R,4S,4aR,8aS)-1,6-dimethyl-4-propan-2-yl-3,4,4a,7,8,8a-hexahydro-2H-naphthalen-1-ol

Molecular formula:

(1S,4S,4aR,8aS)-1,6-dimethyl-4-propan-2-yl-3,4,4a,7,8,8a-hexahydro-2H-naphthalen-1-ol: C15H26O AND (1R,4S,4aR,8aS)-1,6-dimethyl-4-propan-2-yl-3,4,4a,7,8,8a-hexahydro-2H-naphthalen-1-ol: C15H26O

IUPAC Name:

Mixture of (1S,4S,4aR,8aS)-1,6-dimethyl-4-propan-2-yl-3,4,4a,7,8,8a-hexahydro-2H-naphthalen-1-ol and (1R,4S,4aR,8aS)-1,6-dimethyl-4-propan-2-yl-3,4,4a,7,8,8a-hexahydro-2H-naphthalen-1-ol

Constituent 30

Reference substance name:

Mixture of 4,7-dimethyl-1-propan-2-yl-1,2,3,5,6,8a-hexahydronaphthalene (CAS 483-76-1), (1R,4aS,8aS)-7-methyl-4-methylidene-1-propan-2-yl-2,3,4a,5,6,8a-hexahydro-1H-naphthalene (CAS 39029-41-9) and (1S,4aR,8aR)-4,7-dimethyl-1-(propan-2-yl)-1,2,4a,5,6,8a-hexahydronaphthalene (CAS 24406-05-1)

Molecular formula:

(1S,4aR,8aR)-4,7-dimethyl-1-(propan-2-yl)-1,2,4a,5,6,8a-hexahydronaphthalene: C15H24; (1R,4aS,8aS)-7-methyl-4-methylidene-1-propan-2-yl-2,3,4a,5,6,8a-hexahydro-1H-naphthalene: C15H24; 4,7-dimethyl-1-propan-2-yl-1,2,3,5,6,8a-hexahydronaphthalene: C15H24

IUPAC Name:

Mixture of 4,7-dimethyl-1-propan-2-yl-1,2,3,5,6,8a-hexahydronaphthalene (CAS 483-76-1), (1R,4aS,8aS)-7-methyl-4-methylidene-1-propan-2-yl-2,3,4a,5,6,8a-hexahydro-1H-naphthalene (CAS 39029-41-9) and (1S,4aR,8aR)-4,7-dimethyl-1-(propan-2-yl)-1,2,4a,5,6,8a-hexahydronaphthalene (CAS 24406-05-1)

Cymbopogon winterianus, ext.

Constituent 1

Reference substance name:

(R)-p-mentha-1,8-diene

EC Number:

227-813-5

EC Name:

(R)-p-mentha-1,8-diene

CAS Number:

5989-27-5

Molecular formula:

C10H16

IUPAC Name:

(4R)-1-methyl-4-(prop-1-en-2-yl)cyclohexene

Constituent 2

Reference substance name:

(R)-3,7-dimethyloct-6-enal

EC Number:

219-194-5

EC Name:

(R)-3,7-dimethyloct-6-enal

CAS Number:

2385-77-5

Molecular formula:

C10H18O

IUPAC Name:

3,7-dimethyloct-6-enal

Constituent 3

Reference substance name:

Geraniol

EC Number:

203-377-1

EC Name:

Geraniol

CAS Number:

106-24-1

Molecular formula:

C10H18O

IUPAC Name:

(2E)-3,7-dimethylocta-2,6-dien-1-ol

Constituent 4

Reference substance name:

Citronellol

EC Number:

203-375-0

EC Name:

Citronellol

CAS Number:

106-22-9

Molecular formula:

C10H20O

IUPAC Name:

3,7-dimethyloct-6-en-1-ol

Constituent 5

Reference substance name:

Citronellyl acetate

EC Number:

205-775-0

EC Name:

Citronellyl acetate

CAS Number:

150-84-5

Molecular formula:

C12H22O2

IUPAC Name:

3,7-dimethyloct-6-en-1-yl acetate

Constituent 6

Reference substance name:

(1S,2R,4S)-1-ethenyl-1-methyl-2,4-bis(prop-1-en-2-yl)cyclohexane

CAS Number:

515-13-9

Molecular formula:

C15H24

IUPAC Name:

(1S,2R,4S)-1-ethenyl-1-methyl-2,4-bis(prop-1-en-2-yl)cyclohexane

Essential oil obtained from the leaves of Cymbopogon winterianus, Gramineae by distillation

Constituent 1

Reference substance name:

(R)-p-mentha-1,8-diene

EC Number:

227-813-5

EC Name:

(R)-p-mentha-1,8-diene

CAS Number:

5989-27-5

Molecular formula:

C10H16

IUPAC Name:

(4R)-1-methyl-4-(prop-1-en-2-yl)cyclohexene

Constituent 2

Reference substance name:

(R)-3,7-dimethyloct-6-enal

EC Number:

219-194-5

EC Name:

(R)-3,7-dimethyloct-6-enal

CAS Number:

2385-77-5

Molecular formula:

C10H18O

IUPAC Name:

3,7-dimethyloct-6-enal

Constituent 3

Reference substance name:

Geraniol

EC Number:

203-377-1

EC Name:

Geraniol

CAS Number:

106-24-1

Molecular formula:

C10H18O

IUPAC Name:

(2E)-3,7-dimethylocta-2,6-dien-1-ol

Constituent 4

Reference substance name:

Citronellol

EC Number:

203-375-0

EC Name:

Citronellol

CAS Number:

106-22-9

Molecular formula:

C10H20O

IUPAC Name:

3,7-dimethyloct-6-en-1-ol

Constituent 5

Reference substance name:

Citronellyl acetate

EC Number:

205-775-0

EC Name:

Citronellyl acetate

CAS Number:

150-84-5

Molecular formula:

C12H22O2

IUPAC Name:

3,7-dimethyloct-6-en-1-yl acetate

Constituent 6

Reference substance name:

Mixture of 4,7-dimethyl-1-propan-2-yl-1,2,3,5,6,8a-hexahydronaphthalene (CAS 483-76-1), (1R,4aS,8aS)-7-methyl-4-methylidene-1-propan-2-yl-2,3,4a,5,6,8a-hexahydro-1H-naphthalene (CAS 39029-41-9) and (1S,4aR,8aR)-4,7-dimethyl-1-(propan-2-yl)-1,2,4a,5,6,8a-hexahydronaphthalene (CAS 24406-05-1)

Molecular formula:

(1S,4aR,8aR)-4,7-dimethyl-1-(propan-2-yl)-1,2,4a,5,6,8a-hexahydronaphthalene: C15H24 (1R,4aS,8aS)-7-methyl-4-methylidene-1-propan-2-yl-2,3,4a,5,6,8a-hexahydro-1H-naphthalene: C15H24 4,7-dimethyl-1-propan-2-yl-1,2,3,5,6,8a-hexahydronaphthalene: C15H24

IUPAC Name:

Mixture of 4,7-dimethyl-1-propan-2-yl-1,2,3,5,6,8a-hexahydronaphthalene (CAS 483-76-1), (1R,4aS,8aS)-7-methyl-4-methylidene-1-propan-2-yl-2,3,4a,5,6,8a-hexahydro-1H-naphthalene (CAS 39029-41-9) and (1S,4aR,8aR)-4,7-dimethyl-1-(propan-2-yl)-1,2,4a,5,6,8a-hexahydronaphthalene (CAS 24406-05-1)

Constituent 7

Reference substance name:

(1S,2R,4S)-1-ethenyl-1-methyl-2,4-bis(prop-1-en-2-yl)cyclohexane

CAS Number:

515-13-9

Molecular formula:

C15H24

IUPAC Name:

(1S,2R,4S)-1-ethenyl-1-methyl-2,4-bis(prop-1-en-2-yl)cyclohexane

Constituent 8

Reference substance name:

(1S,2S,4R)-(-)-α,α-dimethyl-1-vinyl-o-menth-8-ene-4-methanol

EC Number:

211-360-5

EC Name:

(1S,2S,4R)-(-)-α,α-dimethyl-1-vinyl-o-menth-8-ene-4-methanol

CAS Number:

639-99-6

Molecular formula:

C15H26O

IUPAC Name:

2-(3-isopropenyl-4-methyl-4-vinylcyclohexyl)propan-2-ol

Constituent 9

Reference substance name:

Neryl acetate

EC Number:

205-459-2

EC Name:

Neryl acetate

CAS Number:

141-12-8

Molecular formula:

C12H20O2

IUPAC Name:

2,6-Octadien-1-ol, 3,7-dimethyl-, 1-acetate, (2Z)-

Constituent 10

Reference substance name:

(1S,8aR)-4,7-dimethyl-1-propan-2-yl-1,2,3,5,6,8a-hexahydronaphthalene

CAS Number:

483-76-1

Molecular formula:

C15H24

IUPAC Name:

(1S,8aR)-4,7-dimethyl-1-propan-2-yl-1,2,3,5,6,8a-hexahydronaphthalene

Constituent 11

Reference substance name:

Geranyl butyrate

EC Number:

203-381-3

EC Name:

Geranyl butyrate

CAS Number:

106-29-6

Molecular formula:

C14H24O2

IUPAC Name:

(2E)-3,7-dimethylocta-2,6-dien-1-yl butanoate

Essential oil obtained from the leaves of Cymbopogon winterianus, Gramineae by distillation

State Form:

liquid

Constituent 1

Reference substance name:

(R)-p-mentha-1,8-diene

EC Number:

227-813-5

EC Name:

(R)-p-mentha-1,8-diene

CAS Number:

5989-27-5

Molecular formula:

C10H16

IUPAC Name:

(4R)-1-methyl-4-(prop-1-en-2-yl)cyclohexene

Constituent 2

Reference substance name:

(R)-3,7-dimethyloct-6-enal

EC Number:

219-194-5

EC Name:

(R)-3,7-dimethyloct-6-enal

CAS Number:

2385-77-5

Molecular formula:

C10H18O

IUPAC Name:

3,7-dimethyloct-6-enal

Constituent 3

Reference substance name:

Citronellol

EC Number:

203-375-0

EC Name:

Citronellol

CAS Number:

106-22-9

Molecular formula:

C10H20O

IUPAC Name:

3,7-dimethyloct-6-en-1-ol

Constituent 4

Reference substance name:

Geraniol

EC Number:

203-377-1

EC Name:

Geraniol

CAS Number:

106-24-1

Molecular formula:

C10H18O

IUPAC Name:

(2E)-3,7-dimethylocta-2,6-dien-1-ol

Constituent 5

Reference substance name:

Geranyl acetate

EC Number:

203-341-5

EC Name:

Geranyl acetate

CAS Number:

105-87-3

Molecular formula:

C12H20O2

IUPAC Name:

2,6-Octadien-1-ol, 3,7-dimethyl-, 1-acetate, (2E)-

Constituent 6

Reference substance name:

Camphene

EC Number:

201-234-8

EC Name:

Camphene

CAS Number:

79-92-5

Molecular formula:

C10H16

IUPAC Name:

2,2-dimethyl-3-methylenebicyclo[2.2.1]heptane

Constituent 7

Reference substance name:

Linalool

EC Number:

201-134-4

EC Name:

Linalool

CAS Number:

78-70-6

Molecular formula:

C10H18O

IUPAC Name:

3,7-dimethylocta-1,6-dien-3-ol

Constituent 8

Reference substance name:

Caryophyllene

EC Number:

201-746-1

EC Name:

Caryophyllene

CAS Number:

87-44-5

Molecular formula:

C15H24

IUPAC Name:

4,11,11-trimethyl-8-methylenebicyclo[7.2.0]undec-4-ene

Constituent 9

Reference substance name:

Thuj-4(10)-ene

EC Number:

222-212-4

EC Name:

Thuj-4(10)-ene

CAS Number:

3387-41-5

Molecular formula:

C10H16

IUPAC Name:

Bicyclo(3.1.0)hexane, 4-methylene-1-(1-methylethyl)

Constituent 10

Reference substance name:

7-methyl-3-methyleneocta-1,6-diene

EC Number:

204-622-5

EC Name:

7-methyl-3-methyleneocta-1,6-diene

CAS Number:

123-35-3

Molecular formula:

C10H16

IUPAC Name:

7-methyl-3-methylideneocta-1,6-diene

Constituent 11

Reference substance name:

(Z)-3,7-dimethylocta-1,3,6,-triene

EC Number:

222-081-3

EC Name:

(Z)-3,7-dimethylocta-1,3,6,-triene

CAS Number:

3338-55-4

Molecular formula:

C10H16

IUPAC Name:

3,7-dimethylocta-1,3,6-triene

Constituent 12

Reference substance name:

Isopulegol

EC Number:

201-940-6

EC Name:

Isopulegol

CAS Number:

89-79-2

Molecular formula:

C10H18O

IUPAC Name:

2-isopropenyl-5-methylcyclohexanol

Constituent 13

Reference substance name:

Cyclohexanol, 5-methyl-2-(1-methylethenyl)-, (1S,2R,5R)

CAS Number:

96612-21-4

Molecular formula:

C10H18O

IUPAC Name:

Cyclohexanol, 5-methyl-2-(1-methylethenyl)-, (1S,2R,5R)

Constituent 14

Reference substance name:

Citronellyl acetate

EC Number:

205-775-0

EC Name:

Citronellyl acetate

CAS Number:

150-84-5

Molecular formula:

C12H22O2

IUPAC Name:

3,7-dimethyloct-6-en-1-yl acetate

Constituent 15

Reference substance name:

(1S,4aR,8aR)-4,7-dimethyl-1-(propan-2-yl)-1,2,4a,5,6,8a-hexahydronaphthalene

CAS Number:

24406-05-1

Molecular formula:

C15 H24

IUPAC Name:

(1S,4aR,8aR)-4,7-dimethyl-1-(propan-2-yl)-1,2,4a,5,6,8a-hexahydronaphthalene

Constituent 16

Reference substance name:

Terpineol

EC Number:

232-268-1

EC Name:

Terpineol

CAS Number:

8000-41-7

Molecular formula:

C10H18O

IUPAC Name:

2-(4-methylcyclohex-3-en-1-yl)propan-2-ol

Constituent 17

Reference substance name:

DL-borneol

EC Number:

208-080-0

EC Name:

DL-borneol

CAS Number:

507-70-0

Molecular formula:

C10H18O

IUPAC Name:

1,7,7-trimethylbicyclo[2.2.1]heptan-2-ol

Constituent 18

Reference substance name:

Pin-2(3)-ene

EC Number:

201-291-9

EC Name:

Pin-2(3)-ene

CAS Number:

80-56-8

Molecular formula:

C10H16

IUPAC Name:

4,7,7-trimethylbicyclo[3.1.1]hept-3-ene

Constituent 19

Reference substance name:

1-methyl-2,4-di(prop-1-en-2-yl)-1-vinylcyclohexane

CAS Number:

515-13-9

Molecular formula:

C15H24

IUPAC Name:

1-methyl-2,4-di(prop-1-en-2-yl)-1-vinylcyclohexane

Constituent 20

Reference substance name:

(1S,2S,4R)-(-)-α,α-dimethyl-1-vinyl-o-menth-8-ene-4-methanol

EC Number:

211-360-5

EC Name:

(1S,2S,4R)-(-)-α,α-dimethyl-1-vinyl-o-menth-8-ene-4-methanol

CAS Number:

639-99-6

Molecular formula:

C15H26O

IUPAC Name:

2-(3-isopropenyl-4-methyl-4-vinylcyclohexyl)propan-2-ol

Constituent 21

Reference substance name:

(1E,6E)-1-methyl-5-methylidene-8-propan-2-ylcyclodeca-1,6-diene

CAS Number:

23986-74-5

Molecular formula:

C15 H24

IUPAC Name:

(1E,6E)-1-methyl-5-methylidene-8-propan-2-ylcyclodeca-1,6-diene

Constituent 22

Reference substance name:

Eugenol

EC Number:

202-589-1

EC Name:

Eugenol

CAS Number:

97-53-0

Molecular formula:

C10H12O2

IUPAC Name:

4-allyl-2-methoxyphenol

Constituent 23

Reference substance name:

(E)-3,7-dimethylocta-2,6-dienal

EC Number:

205-476-5

EC Name:

(E)-3,7-dimethylocta-2,6-dienal

CAS Number:

141-27-5

Molecular formula:

C10H16O

IUPAC Name:

(2E)-3,7-dimethylocta-2,6-dienal

Constituent 24

Reference substance name:

(1R,4S,4aR,8aS)-1,6-dimethyl-4-propan-2-yl-3,4,4a,7,8,8a-hexahydro-2H-naphthalen-1-ol

CAS Number:

19435-97-3

Molecular formula:

C15H26O

IUPAC Name:

(1R,4S,4aR,8aS)-1,6-dimethyl-4-propan-2-yl-3,4,4a,7,8,8a-hexahydro-2H-naphthalen-1-ol

Constituent 25

Reference substance name:

p-mentha-1,4(8)-diene

EC Number:

209-578-0

EC Name:

p-mentha-1,4(8)-diene

CAS Number:

586-62-9

Molecular formula:

C10H16

IUPAC Name:

4-isopropylidene-1-methylcyclohexene

Constituent 26

Reference substance name:

Decanal

EC Number:

203-957-4

EC Name:

Decanal

CAS Number:

112-31-2

Molecular formula:

C10H20O

IUPAC Name:

1-decyl aldehyde

Constituent 27

Reference substance name:

Farnesol

EC Number:

225-004-1

EC Name:

Farnesol

CAS Number:

4602-84-0

Molecular formula:

C15H26O

IUPAC Name:

3,7,11-trimethyldodeca-2,6,10-trien-1-ol

Constituent 28

Reference substance name:

p-mentha-1(7),2-diene

EC Number:

209-081-9

EC Name:

p-mentha-1(7),2-diene

CAS Number:

555-10-2

Molecular formula:

C10H16

IUPAC Name:

3-methylidene-6-propan-2-ylcyclohexene

Constituent 29

Reference substance name:

p-cymene

EC Number:

202-796-7

EC Name:

p-cymene

CAS Number:

99-87-6

Molecular formula:

C10H14

IUPAC Name:

1-isopropyl-4-methylbenzene

Constituent 30

Reference substance name:

Nerol

EC Number:

203-378-7

EC Name:

Nerol

CAS Number:

106-25-2

Molecular formula:

C10H18O

IUPAC Name:

2,6-Octadien-1-ol, 3,7-dimethyl-, (2Z)-

Constituent 31

Reference substance name:

Neryl acetate

EC Number:

205-459-2

EC Name:

Neryl acetate

CAS Number:

141-12-8

Molecular formula:

C12H20O2

IUPAC Name:

2,6-Octadien-1-ol, 3,7-dimethyl-, 1-acetate, (2Z)-

Constituent 32

Reference substance name:

Unknown and other minor constituents in Cymbopogon winterianus extracts

IUPAC Name:

Unknown and other minor constituents in Cymbopogon winterianus extracts

Essential oil obtained from the leaves of Cymbopogon winterianus, Gramineae by distillation

State Form:

liquid

Constituent 1

Reference substance name:

(R)-p-mentha-1,8-diene

EC Number:

227-813-5

EC Name:

(R)-p-mentha-1,8-diene

CAS Number:

5989-27-5

Molecular formula:

C10H16

IUPAC Name:

(4R)-1-methyl-4-(prop-1-en-2-yl)cyclohexene

Constituent 2

Reference substance name:

(R)-3,7-dimethyloct-6-enal

EC Number:

219-194-5

EC Name:

(R)-3,7-dimethyloct-6-enal

CAS Number:

2385-77-5

Molecular formula:

C10H18O

IUPAC Name:

3,7-dimethyloct-6-enal

Constituent 3

Reference substance name:

Geraniol

EC Number:

203-377-1

EC Name:

Geraniol

CAS Number:

106-24-1

Molecular formula:

C10H18O

IUPAC Name:

(2E)-3,7-dimethylocta-2,6-dien-1-ol

Constituent 4

Reference substance name:

Citronellol

EC Number:

203-375-0

EC Name:

Citronellol

CAS Number:

106-22-9

Molecular formula:

C10H20O

IUPAC Name:

3,7-dimethyloct-6-en-1-ol

Constituent 5

Reference substance name:

Geranyl acetate

EC Number:

203-341-5

EC Name:

Geranyl acetate

CAS Number:

105-87-3

Molecular formula:

C12H20O2

IUPAC Name:

2,6-Octadien-1-ol, 3,7-dimethyl-, 1-acetate, (2E)-

Constituent 6

Reference substance name:

Camphene

EC Number:

201-234-8

EC Name:

Camphene

CAS Number:

79-92-5

Molecular formula:

C10H16

IUPAC Name:

2,2-dimethyl-3-methylenebicyclo[2.2.1]heptane

Constituent 7

Reference substance name:

Linalool

EC Number:

201-134-4

EC Name:

Linalool

CAS Number:

78-70-6

Molecular formula:

C10H18O

IUPAC Name:

3,7-dimethylocta-1,6-dien-3-ol

Constituent 8

Reference substance name:

Caryophyllene

EC Number:

201-746-1

EC Name:

Caryophyllene

CAS Number:

87-44-5

Molecular formula:

C15H24

IUPAC Name:

4,11,11-trimethyl-8-methylenebicyclo[7.2.0]undec-4-ene

Constituent 9

Reference substance name:

Thuj-4(10)-ene

EC Number:

222-212-4

EC Name:

Thuj-4(10)-ene

CAS Number:

3387-41-5

Molecular formula:

C10H16

IUPAC Name:

Bicyclo(3.1.0)hexane, 4-methylene-1-(1-methylethyl)

Constituent 10

Reference substance name:

7-methyl-3-methyleneocta-1,6-diene

EC Number:

204-622-5

EC Name:

7-methyl-3-methyleneocta-1,6-diene

CAS Number:

123-35-3

Molecular formula:

C10H16

IUPAC Name:

7-methyl-3-methylideneocta-1,6-diene

Constituent 11

Reference substance name:

Mixture of (3Z)-3,7-dimethylocta-1,3,6-triene and (3E)-3,7-dimethylocta-1,3,6-triene

Molecular formula:

(3Z)-3,7-dimethylocta-1,3,6-triene: C10H16 (3E)-3,7-dimethylocta-1,3,6-triene: C10H16

IUPAC Name:

Mixture of (3Z)-3,7-dimethylocta-1,3,6-triene and (3E)-3,7-dimethylocta-1,3,6-triene

Constituent 12

Reference substance name:

(1S*, 2R*, 5S*)-2-Isopropenyl-5-methylcyclohexanol

Molecular formula:

C10H18O

IUPAC Name:

(1S*, 2R*, 5S*)-2-Isopropenyl-5-methylcyclohexanol

Constituent 13

Reference substance name:

Cyclohexanol, 5-methyl-2-(1-methylethenyl)-, (1S,2R,5R)-

CAS Number:

96612-21-4

Molecular formula:

C10H18O

IUPAC Name:

Cyclohexanol, 5-methyl-2-(1-methylethenyl)-, (1S,2R,5R)-

Constituent 14

Reference substance name:

Citronellyl acetate

EC Number:

205-775-0

EC Name:

Citronellyl acetate

CAS Number:

150-84-5

Molecular formula:

C12H22O2

IUPAC Name:

3,7-dimethyloct-6-en-1-yl acetate

Constituent 15

Reference substance name:

Mixture of 4,7-dimethyl-1-propan-2-yl-1,2,3,5,6,8a-hexahydronaphthalene (CAS 483-76-1), (1R,4aS,8aS)-7-methyl-4-methylidene-1-propan-2-yl-2,3,4a,5,6,8a-hexahydro-1H-naphthalene (CAS 39029-41-9) and (1S,4aR,8aR)-4,7-dimethyl-1-(propan-2-yl)-1,2,4a,5,6,8a-hexahydronaphthalene (CAS 24406-05-1)

Molecular formula:

(1S,4aR,8aR)-4,7-dimethyl-1-(propan-2-yl)-1,2,4a,5,6,8a-hexahydronaphthalene: C15H24 (1R,4aS,8aS)-7-methyl-4-methylidene-1-propan-2-yl-2,3,4a,5,6,8a-hexahydro-1H-naphthalene: C15H24 4,7-dimethyl-1-propan-2-yl-1,2,3,5,6,8a-hexahydronaphthalene: C15H24

IUPAC Name:

Mixture of 4,7-dimethyl-1-propan-2-yl-1,2,3,5,6,8a-hexahydronaphthalene (CAS 483-76-1), (1R,4aS,8aS)-7-methyl-4-methylidene-1-propan-2-yl-2,3,4a,5,6,8a-hexahydro-1H-naphthalene (CAS 39029-41-9) and (1S,4aR,8aR)-4,7-dimethyl-1-(propan-2-yl)-1,2,4a,5,6,8a-hexahydronaphthalene (CAS 24406-05-1)

Constituent 16

Reference substance name:

Terpineol

EC Number:

232-268-1

EC Name:

Terpineol

CAS Number:

8000-41-7

Molecular formula:

C10H18O

IUPAC Name:

2-(4-methylcyclohex-3-en-1-yl)propan-2-ol

Constituent 17

Reference substance name:

DL-borneol

EC Number:

208-080-0

EC Name:

DL-borneol

CAS Number:

507-70-0

Molecular formula:

C10H18O

IUPAC Name:

1,7,7-trimethylbicyclo[2.2.1]heptan-2-ol

Constituent 18

Reference substance name:

Pin-2(3)-ene

EC Number:

201-291-9

EC Name:

Pin-2(3)-ene

CAS Number:

80-56-8

Molecular formula:

C10H16

IUPAC Name:

4,7,7-trimethylbicyclo[3.1.1]hept-3-ene

Constituent 19

Reference substance name:

(1S,2R,4S)-1-ethenyl-1-methyl-2,4-bis(prop-1-en-2-yl)cyclohexane

CAS Number:

515-13-9

Molecular formula:

C15H24

IUPAC Name:

(1S,2R,4S)-1-ethenyl-1-methyl-2,4-bis(prop-1-en-2-yl)cyclohexane

Constituent 20

Reference substance name:

(1S,2S,4R)-(-)-α,α-dimethyl-1-vinyl-o-menth-8-ene-4-methanol

EC Number:

211-360-5

EC Name:

(1S,2S,4R)-(-)-α,α-dimethyl-1-vinyl-o-menth-8-ene-4-methanol

CAS Number:

639-99-6

Molecular formula:

C15H26O

IUPAC Name:

2-(3-isopropenyl-4-methyl-4-vinylcyclohexyl)propan-2-ol

Constituent 21

Reference substance name:

(1E,6E)-1-methyl-5-methylidene-8-propan-2-ylcyclodeca-1,6-diene

CAS Number:

23986-74-5

Molecular formula:

C15H24

IUPAC Name:

(1E,6E)-1-methyl-5-methylidene-8-propan-2-ylcyclodeca-1,6-diene

Constituent 22

Reference substance name:

Eugenol

EC Number:

202-589-1

EC Name:

Eugenol

CAS Number:

97-53-0

Molecular formula:

C10H12O2

IUPAC Name:

4-allyl-2-methoxyphenol

Constituent 23

Reference substance name:

(E)-3,7-dimethylocta-2,6-dienal

EC Number:

205-476-5

EC Name:

(E)-3,7-dimethylocta-2,6-dienal

CAS Number:

141-27-5

Molecular formula:

C10H16O

IUPAC Name:

(2E)-3,7-dimethylocta-2,6-dienal

Constituent 24

Reference substance name:

Mixture of (1S,4S,4aR,8aS)-1,6-dimethyl-4-propan-2-yl-3,4,4a,7,8,8a-hexahydro-2H-naphthalen-1-ol and (1R,4S,4aR,8aS)-1,6-dimethyl-4-propan-2-yl-3,4,4a,7,8,8a-hexahydro-2H-naphthalen-1-ol

Molecular formula:

(1S,4S,4aR,8aS)-1,6-dimethyl-4-propan-2-yl-3,4,4a,7,8,8a-hexahydro-2H-naphthalen-1-ol: C15H26O (1R,4S,4aR,8aS)-1,6-dimethyl-4-propan-2-yl-3,4,4a,7,8,8a-hexahydro-2H-naphthalen-1-ol: C15H26O

IUPAC Name:

Mixture of (1S,4S,4aR,8aS)-1,6-dimethyl-4-propan-2-yl-3,4,4a,7,8,8a-hexahydro-2H-naphthalen-1-ol and (1R,4S,4aR,8aS)-1,6-dimethyl-4-propan-2-yl-3,4,4a,7,8,8a-hexahydro-2H-naphthalen-1-ol

Constituent 25

Reference substance name:

Nerol

EC Number:

203-378-7

EC Name:

Nerol

CAS Number:

106-25-2

Molecular formula:

C10H18O

IUPAC Name:

2,6-Octadien-1-ol, 3,7-dimethyl-, (2Z)-

Constituent 26

Reference substance name:

p-mentha-1,4(8)-diene

EC Number:

209-578-0

EC Name:

p-mentha-1,4(8)-diene

CAS Number:

586-62-9

Molecular formula:

C10H16

IUPAC Name:

4-isopropylidene-1-methylcyclohexene

Constituent 27

Reference substance name:

Decanal

EC Number:

203-957-4

EC Name:

Decanal

CAS Number:

112-31-2

Molecular formula:

C10H20O

IUPAC Name:

1-decyl aldehyde

Constituent 28

Reference substance name:

Farnesol

EC Number:

225-004-1

EC Name:

Farnesol

CAS Number:

4602-84-0

Molecular formula:

C15H26O

IUPAC Name:

3,7,11-trimethyldodeca-2,6,10-trien-1-ol

Constituent 29

Reference substance name:

p-mentha-1(7),2-diene

EC Number:

209-081-9

EC Name:

p-mentha-1(7),2-diene

CAS Number:

555-10-2

Molecular formula:

C10H16

IUPAC Name:

3-methylidene-6-propan-2-ylcyclohexene

Constituent 30

Reference substance name:

Neryl acetate

EC Number:

205-459-2

EC Name:

Neryl acetate

CAS Number:

141-12-8

Molecular formula:

C12H20O2

IUPAC Name:

2,6-Octadien-1-ol, 3,7-dimethyl-, 1-acetate, (2Z)-

Constituent 31

Reference substance name:

p-cymene

EC Number:

202-796-7

EC Name:

p-cymene

CAS Number:

99-87-6

Molecular formula:

C10H14

IUPAC Name:

1-isopropyl-4-methylbenzene

Constituent 32

Reference substance name:

Unknown and other minor constituents in Cymbopogon winterianus extracts

IUPAC Name:

Unknown and other minor constituents in Cymbopogon winterianus extracts

Cymbopogon winterianus, ext.

State Form:

liquid

Constituent 1

Reference substance name:

(R)-p-mentha-1,8-diene

EC Number:

227-813-5

EC Name:

(R)-p-mentha-1,8-diene

CAS Number:

5989-27-5

Molecular formula:

C10H16

IUPAC Name:

(4R)-1-methyl-4-(prop-1-en-2-yl)cyclohexene

Constituent 2

Reference substance name:

(Z)-3,7-dimethylocta-1,3,6,-triene

EC Number:

222-081-3

EC Name:

(Z)-3,7-dimethylocta-1,3,6,-triene

CAS Number:

3338-55-4

Molecular formula:

C10H16

IUPAC Name:

3,7-dimethylocta-1,3,6-triene

Constituent 3

Reference substance name:

Nerol

EC Number:

203-378-7

EC Name:

Nerol

CAS Number:

106-25-2

Molecular formula:

C10H18O

IUPAC Name:

2,6-Octadien-1-ol, 3,7-dimethyl-, (2Z)-

Constituent 4

Reference substance name:

1,6-Cyclodecadiene, 1-methyl-5-methylene-8-(1-methylethyl)-, (S-(E,E))-

CAS Number:

23986-74-5

Molecular formula:

C15-H24

IUPAC Name:

1,6-Cyclodecadiene, 1-methyl-5-methylene-8-(1-methylethyl)-, (S-(E,E))-

Constituent 5

Reference substance name:

(1S,2S,4R)-(-)-α,α-dimethyl-1-vinyl-o-menth-8-ene-4-methanol

EC Number:

211-360-5

EC Name:

(1S,2S,4R)-(-)-α,α-dimethyl-1-vinyl-o-menth-8-ene-4-methanol

CAS Number:

639-99-6

Molecular formula:

C15H26O

IUPAC Name:

2-(3-isopropenyl-4-methyl-4-vinylcyclohexyl)propan-2-ol

Constituent 6

Reference substance name:

delta-Cadinene

CAS Number:

483-76-1

Molecular formula:

C15-H24

IUPAC Name:

delta-Cadinene

Constituent 7

Reference substance name:

1-methyl-2,4-di(prop-1-en-2-yl)-1-vinylcyclohexane

EC Number:

610-676-4

CAS Number:

515-13-9

Molecular formula:

C15-H24

IUPAC Name:

1-methyl-2,4-di(prop-1-en-2-yl)-1-vinylcyclohexane

Constituent 8

Reference substance name:

Citronellyl acetate

EC Number:

205-775-0

EC Name:

Citronellyl acetate

CAS Number:

150-84-5

Molecular formula:

C12H22O2

IUPAC Name:

3,7-dimethyloct-6-en-1-yl acetate

Constituent 9

Reference substance name:

Isopulegol

EC Number:

201-940-6

EC Name:

Isopulegol

CAS Number:

89-79-2

Molecular formula:

C10H18O

IUPAC Name:

2-isopropenyl-5-methylcyclohexanol

Constituent 10

Reference substance name:

Caryophyllene

EC Number:

201-746-1

EC Name:

Caryophyllene

CAS Number:

87-44-5

Molecular formula:

C15H24

IUPAC Name:

4,11,11-trimethyl-8-methylenebicyclo[7.2.0]undec-4-ene

Constituent 11

Reference substance name:

Linalool

EC Number:

201-134-4

EC Name:

Linalool

CAS Number:

78-70-6

Molecular formula:

C10H18O

IUPAC Name:

3,7-dimethylocta-1,6-dien-3-ol

Constituent 12

Reference substance name:

Geranyl acetate

EC Number:

203-341-5

EC Name:

Geranyl acetate

CAS Number:

105-87-3

Molecular formula:

C12H20O2

IUPAC Name:

2,6-Octadien-1-ol, 3,7-dimethyl-, 1-acetate, (2E)-

Constituent 13

Reference substance name:

(R)-3,7-dimethyloct-6-enal

EC Number:

219-194-5

EC Name:

(R)-3,7-dimethyloct-6-enal

CAS Number:

2385-77-5

Molecular formula:

C10H18O

IUPAC Name:

3,7-dimethyloct-6-enal

Constituent 14

Reference substance name:

Geraniol

EC Number:

203-377-1

EC Name:

Geraniol

CAS Number:

106-24-1

Molecular formula:

C10H18O

IUPAC Name:

(2E)-3,7-dimethylocta-2,6-dien-1-ol

Constituent 15

Reference substance name:

Citronellol

EC Number:

203-375-0

EC Name:

Citronellol

CAS Number:

106-22-9

Molecular formula:

C10H20O

IUPAC Name:

3,7-dimethyloct-6-en-1-ol

Essential oil obtained from the leaves of Cymbopogon winterianus, Gramineae by distillation

State Form:

liquid

Constituent 1

Reference substance name:

(R)-p-mentha-1,8-diene

EC Number:

227-813-5

EC Name:

(R)-p-mentha-1,8-diene

CAS Number:

5989-27-5

Molecular formula:

C10H16

IUPAC Name:

(4R)-1-methyl-4-(prop-1-en-2-yl)cyclohexene

Constituent 2

Reference substance name:

(R)-3,7-dimethyloct-6-enal

EC Number:

219-194-5

EC Name:

(R)-3,7-dimethyloct-6-enal

CAS Number:

2385-77-5

Molecular formula:

C10H18O

IUPAC Name:

3,7-dimethyloct-6-enal

Constituent 3

Reference substance name:

Geraniol

EC Number:

203-377-1

EC Name:

Geraniol

CAS Number:

106-24-1

Molecular formula:

C10H18O

IUPAC Name:

(2E)-3,7-dimethylocta-2,6-dien-1-ol

Constituent 4

Reference substance name:

Citronellol

EC Number:

203-375-0

EC Name:

Citronellol

CAS Number:

106-22-9

Molecular formula:

C10H20O

IUPAC Name:

3,7-dimethyloct-6-en-1-ol

Constituent 5

Reference substance name:

Geranyl acetate

EC Number:

203-341-5

EC Name:

Geranyl acetate

CAS Number:

105-87-3

Molecular formula:

C12H20O2

IUPAC Name:

2,6-Octadien-1-ol, 3,7-dimethyl-, 1-acetate, (2E)-

Constituent 6

Reference substance name:

Linalool

EC Number:

201-134-4

EC Name:

Linalool

CAS Number:

78-70-6

Molecular formula:

C10H18O

IUPAC Name:

3,7-dimethylocta-1,6-dien-3-ol

Constituent 7

Reference substance name:

Isopulegol

EC Number:

201-940-6

EC Name:

Isopulegol

CAS Number:

89-79-2

Molecular formula:

C10H18O

IUPAC Name:

2-isopropenyl-5-methylcyclohexanol

Constituent 8

Reference substance name:

Citronellyl acetate

EC Number:

205-775-0

EC Name:

Citronellyl acetate

CAS Number:

150-84-5

Molecular formula:

C12H22O2

IUPAC Name:

3,7-dimethyloct-6-en-1-yl acetate

Constituent 9

Reference substance name:

Mixture of 4,7-dimethyl-1-propan-2-yl-1,2,3,5,6,8a-hexahydronaphthalene (CAS 483-76-1), (1R,4aS,8aS)-7-methyl-4-methylidene-1-propan-2-yl-2,3,4a,5,6,8a-hexahydro-1H-naphthalene (CAS 39029-41-9) and (1S,4aR,8aR)-4,7-dimethyl-1-(propan-2-yl)-1,2,4a,5,6,8a-hexahydronaphthalene (CAS 24406-05-1)

Molecular formula:

(1S,4aR,8aR)-4,7-dimethyl-1-(propan-2-yl)-1,2,4a,5,6,8a-hexahydronaphthalene: C15H24 (1R,4aS,8aS)-7-methyl-4-methylidene-1-propan-2-yl-2,3,4a,5,6,8a-hexahydro-1H-naphthalene: C15H24 4,7-dimethyl-1-propan-2-yl-1,2,3,5,6,8a-hexahydronaphthalene: C15H24

IUPAC Name:

Mixture of 4,7-dimethyl-1-propan-2-yl-1,2,3,5,6,8a-hexahydronaphthalene (CAS 483-76-1), (1R,4aS,8aS)-7-methyl-4-methylidene-1-propan-2-yl-2,3,4a,5,6,8a-hexahydro-1H-naphthalene (CAS 39029-41-9) and (1S,4aR,8aR)-4,7-dimethyl-1-(propan-2-yl)-1,2,4a,5,6,8a-hexahydronaphthalene (CAS 24406-05-1)

Constituent 10

Reference substance name:

(1S,2R,4S)-1-ethenyl-1-methyl-2,4-bis(prop-1-en-2-yl)cyclohexane

CAS Number:

515-13-9

Molecular formula:

C15H24

IUPAC Name:

(1S,2R,4S)-1-ethenyl-1-methyl-2,4-bis(prop-1-en-2-yl)cyclohexane

Constituent 11

Reference substance name:

(1S,2S,4R)-(-)-α,α-dimethyl-1-vinyl-o-menth-8-ene-4-methanol

EC Number:

211-360-5

EC Name:

(1S,2S,4R)-(-)-α,α-dimethyl-1-vinyl-o-menth-8-ene-4-methanol

CAS Number:

639-99-6

Molecular formula:

C15H26O

IUPAC Name:

2-(3-isopropenyl-4-methyl-4-vinylcyclohexyl)propan-2-ol

Constituent 12

Reference substance name:

(1E,6E)-1-methyl-5-methylidene-8-propan-2-ylcyclodeca-1,6-diene

CAS Number:

23986-74-5

Molecular formula:

C15H24

IUPAC Name:

(1E,6E)-1-methyl-5-methylidene-8-propan-2-ylcyclodeca-1,6-diene

Constituent 13

Reference substance name:

Eugenol

EC Number:

202-589-1

EC Name:

Eugenol

CAS Number:

97-53-0

Molecular formula:

C10H12O2

IUPAC Name:

4-allyl-2-methoxyphenol

Constituent 14

Reference substance name:

(E)-3,7-dimethylocta-2,6-dienal

EC Number:

205-476-5

EC Name:

(E)-3,7-dimethylocta-2,6-dienal

CAS Number:

141-27-5

Molecular formula:

C10H16O

IUPAC Name:

(2E)-3,7-dimethylocta-2,6-dienal

Constituent 15

Reference substance name:

(Z)-3,7-dimethylocta-2,6-dienal

EC Number:

203-379-2

EC Name:

(Z)-3,7-dimethylocta-2,6-dienal

CAS Number:

106-26-3

Molecular formula:

C10H16O

IUPAC Name:

3,7-dimethylocta-2,6-dienal

Constituent 16

Reference substance name:

Unknown and other minor constituents in Cymbopogon winterianus extracts

IUPAC Name:

Unknown and other minor constituents in Cymbopogon winterianus extracts

Citronella Oil Asian Filt

State Form:

liquid

Constituent 1

Reference substance name:

(R)-p-mentha-1,8-diene

EC Number:

227-813-5

EC Name:

(R)-p-mentha-1,8-diene

CAS Number:

5989-27-5

Molecular formula:

C10H16

IUPAC Name:

(4R)-1-methyl-4-(prop-1-en-2-yl)cyclohexene

Constituent 2

Reference substance name:

(R)-3,7-dimethyloct-6-enal

EC Number:

219-194-5

EC Name:

(R)-3,7-dimethyloct-6-enal

CAS Number:

2385-77-5

Molecular formula:

C10H18O

IUPAC Name:

3,7-dimethyloct-6-enal

Constituent 3

Reference substance name:

Geraniol

EC Number:

203-377-1

EC Name:

Geraniol

CAS Number:

106-24-1

Molecular formula:

C10H18O

IUPAC Name:

(2E)-3,7-dimethylocta-2,6-dien-1-ol

Constituent 4

Reference substance name:

Citronellol

EC Number:

203-375-0

EC Name:

Citronellol

CAS Number:

106-22-9

Molecular formula:

C10H20O

IUPAC Name:

3,7-dimethyloct-6-en-1-ol

Constituent 5

Reference substance name:

Geranyl acetate

EC Number:

203-341-5

EC Name:

Geranyl acetate

CAS Number:

105-87-3

Molecular formula:

C12H20O2

IUPAC Name:

2,6-Octadien-1-ol, 3,7-dimethyl-, 1-acetate, (2E)-

Constituent 6

Reference substance name:

Citronellyl acetate

EC Number:

205-775-0

EC Name:

Citronellyl acetate

CAS Number:

150-84-5

Molecular formula:

C12H22O2

IUPAC Name:

3,7-dimethyloct-6-en-1-yl acetate

Constituent 7

Reference substance name:

Eugenol

EC Number:

202-589-1

EC Name:

Eugenol

CAS Number:

97-53-0

Molecular formula:

C10H12O2

IUPAC Name:

4-allyl-2-methoxyphenol

Constituent 8

Reference substance name:

(1S,2S,4R)-1-ethenyl-1-methyl-2,4-di(prop-1-en-2-yl)cyclohexane

CAS Number:

13833-25-5

Molecular formula:

C15H24

IUPAC Name:

(1S,2S,4R)-1-ethenyl-1-methyl-2,4-di(prop-1-en-2-yl)cyclohexane

Constituent 9

Reference substance name:

(6E,8S)‐1‐methyl‐5‐methylidene‐8‐(propan‐2‐yl)cyclodeca‐1,6‐diene

CAS Number:

23986-74-5

Molecular formula:

C15H24

IUPAC Name:

(6E,8S)‐1‐methyl‐5‐methylidene‐8‐(propan‐2‐yl)cyclodeca‐1,6‐diene

Constituent 10

Reference substance name:

(1R,8aR)-1,6-dimethyl-4-(propan-2-yl)-1,2,3,7,8,8a-hexahydronaphthalene

CAS Number:

41929-05-9

Molecular formula:

C15H24

IUPAC Name:

(1R,8aR)-1,6-dimethyl-4-(propan-2-yl)-1,2,3,7,8,8a-hexahydronaphthalene

Constituent 11

Reference substance name:

(1S,2S,4R)-(-)-α,α-dimethyl-1-vinyl-o-menth-8-ene-4-methanol

EC Number:

211-360-5

EC Name:

(1S,2S,4R)-(-)-α,α-dimethyl-1-vinyl-o-menth-8-ene-4-methanol

CAS Number:

639-99-6

Molecular formula:

C15H26O

IUPAC Name:

2-(3-isopropenyl-4-methyl-4-vinylcyclohexyl)propan-2-ol

Constituent 12

Reference substance name:

(1R,4S,4aR,8aR)-1,6-dimethyl-4-(propan-2-yl)-1,2,3,4,4a,7,8,8a-octahydronaphthalen-1-ol

CAS Number:

481-34-5

Molecular formula:

C15H26O

IUPAC Name:

(1R,4S,4aR,8aR)-1,6-dimethyl-4-(propan-2-yl)-1,2,3,4,4a,7,8,8a-octahydronaphthalen-1-ol

Constituent 13

Reference substance name:

Other - unknown constituents

Molecular formula:

NA

IUPAC Name:

Other - unknown constituents

Essential oil obtained from the leaves of Cymbopogon winterianus, Gramineae by distillation

State Form:

liquid

Constituent 1

Reference substance name:

Nerol

EC Number:

203-378-7

EC Name:

Nerol

CAS Number:

106-25-2

Molecular formula:

C10H18O

IUPAC Name:

2,6-Octadien-1-ol, 3,7-dimethyl-, (2Z)-

Constituent 2

Reference substance name:

Eugenol

EC Number:

202-589-1

EC Name:

Eugenol

CAS Number:

97-53-0

Molecular formula:

C10H12O2

IUPAC Name:

4-allyl-2-methoxyphenol

Constituent 3

Reference substance name:

(1E,6E)-1-methyl-5-methylidene-8-propan-2-ylcyclodeca-1,6-diene

CAS Number:

23986-74-5

Molecular formula:

C15H24

IUPAC Name:

(1E,6E)-1-methyl-5-methylidene-8-propan-2-ylcyclodeca-1,6-diene

Constituent 4

Reference substance name:

(1S,2S,4R)-(-)-α,α-dimethyl-1-vinyl-o-menth-8-ene-4-methanol

EC Number:

211-360-5

EC Name:

(1S,2S,4R)-(-)-α,α-dimethyl-1-vinyl-o-menth-8-ene-4-methanol

CAS Number:

639-99-6

Molecular formula:

C15H26O

IUPAC Name:

2-(3-isopropenyl-4-methyl-4-vinylcyclohexyl)propan-2-ol

Constituent 5

Reference substance name:

(1S,2R,4S)-1-ethenyl-1-methyl-2,4-bis(prop-1-en-2-yl)cyclohexane

CAS Number:

515-13-9

Molecular formula:

C15H24

IUPAC Name:

(1S,2R,4S)-1-ethenyl-1-methyl-2,4-bis(prop-1-en-2-yl)cyclohexane

Constituent 6

Reference substance name:

4,7-dimethyl-1-(propan-2-yl)-1,2,3,5,6,8a-hexahydronaphthalene

CAS Number:

483-76-1

Molecular formula:

C15H24

IUPAC Name:

4,7-dimethyl-1-(propan-2-yl)-1,2,3,5,6,8a-hexahydronaphthalene

Constituent 7

Reference substance name:

Citronellyl acetate

EC Number:

205-775-0

EC Name:

Citronellyl acetate

CAS Number:

150-84-5

Molecular formula:

C12H22O2

IUPAC Name:

3,7-dimethyloct-6-en-1-yl acetate

Constituent 8

Reference substance name:

Isopulegol

EC Number:

201-940-6

EC Name:

Isopulegol

CAS Number:

89-79-2

Molecular formula:

C10H18O

IUPAC Name:

2-isopropenyl-5-methylcyclohexanol

Constituent 9

Reference substance name:

Linalool

EC Number:

201-134-4

EC Name:

Linalool

CAS Number:

78-70-6

Molecular formula:

C10H18O

IUPAC Name:

3,7-dimethylocta-1,6-dien-3-ol

Constituent 10

Reference substance name:

Geranyl acetate

EC Number:

203-341-5

EC Name:

Geranyl acetate

CAS Number:

105-87-3

Molecular formula:

C12H20O2

IUPAC Name:

2,6-Octadien-1-ol, 3,7-dimethyl-, 1-acetate, (2E)-

Constituent 11

Reference substance name:

Citronellol

EC Number:

203-375-0

EC Name:

Citronellol

CAS Number:

106-22-9

Molecular formula:

C10H20O

IUPAC Name:

3,7-dimethyloct-6-en-1-ol

Constituent 12

Reference substance name:

Geraniol

EC Number:

203-377-1

EC Name:

Geraniol

CAS Number:

106-24-1

Molecular formula:

C10H18O

IUPAC Name:

(2E)-3,7-dimethylocta-2,6-dien-1-ol

Constituent 13

Reference substance name:

(R)-3,7-dimethyloct-6-enal

EC Number:

219-194-5

EC Name:

(R)-3,7-dimethyloct-6-enal

CAS Number:

2385-77-5

Molecular formula:

C10H18O

IUPAC Name:

3,7-dimethyloct-6-enal

Constituent 14

Reference substance name:

(R)-p-mentha-1,8-diene

EC Number:

227-813-5

EC Name:

(R)-p-mentha-1,8-diene

CAS Number:

5989-27-5

Molecular formula:

C10H16

IUPAC Name:

(4R)-1-methyl-4-(prop-1-en-2-yl)cyclohexene

Composition(s) generated upon use

Other types of composition(s)

Muurolol -- Lead Constituent

State Form:

liquid

Constituent 1

Reference substance name:

Mixture of (1S,4S,4aR,8aS)-1,6-dimethyl-4-propan-2-yl-3,4,4a,7,8,8a-hexahydro-2H-naphthalen-1-ol and (1R,4S,4aR,8aS)-1,6-dimethyl-4-propan-2-yl-3,4,4a,7,8,8a-hexahydro-2H-naphthalen-1-ol

Molecular formula:

(1S,4S,4aR,8aS)-1,6-dimethyl-4-propan-2-yl-3,4,4a,7,8,8a-hexahydro-2H-naphthalen-1-ol: C15H26O (1R,4S,4aR,8aS)-1,6-dimethyl-4-propan-2-yl-3,4,4a,7,8,8a-hexahydro-2H-naphthalen-1-ol: C15H26O

IUPAC Name:

Mixture of (1S,4S,4aR,8aS)-1,6-dimethyl-4-propan-2-yl-3,4,4a,7,8,8a-hexahydro-2H-naphthalen-1-ol and (1R,4S,4aR,8aS)-1,6-dimethyl-4-propan-2-yl-3,4,4a,7,8,8a-hexahydro-2H-naphthalen-1-ol

Geraniol -- Lead Constituent

State Form:

liquid

Constituent 1

Reference substance name:

Geraniol

EC Number:

203-377-1

EC Name:

Geraniol

CAS Number:

106-24-1

Molecular formula:

C10H18O

IUPAC Name:

(2E)-3,7-dimethylocta-2,6-dien-1-ol

Composition - Germacrene D -- Lead Constituent

State Form:

liquid

Constituent 1

Reference substance name:

(1Z,6Z)-1-methyl-5-methylidene-8-(propan-2-yl)cyclodeca-1,6-diene

CAS Number:

37839-63-7

Molecular formula:

C15H24

IUPAC Name:

(1Z,6Z)-1-methyl-5-methylidene-8-(propan-2-yl)cyclodeca-1,6-diene

Germacrene D -- Lead Constituent

State Form:

liquid

Constituent 1

Reference substance name:

(1E,6E,8S)-1-methyl-5-methylidene-8-propan-2-ylcyclodeca-1,6-diene

CAS Number:

23986-74-5

Molecular formula:

C15H24

IUPAC Name:

(1E,6E,8S)-1-methyl-5-methylidene-8-propan-2-ylcyclodeca-1,6-diene