Essential oil of Platycladus orientalis (L.) Franco obtained from branches and leaves by steam distillation followed by vacuum distillation

Substance identity

Identification

Display Name:

(1R,4R,5S)-4-methyl-1-(propan-2-yl)bicyclo[3.1.0]hexan-3-one; 1,3,3-trimethylbicyclo[2.2.1]heptan-2-one; 4-methylidene-1-(propan-2-yl)bicyclo[3.1.0]hexan-3-yl acetate; 4-methylidene-1-(propan-2-yl)bicyclo[3.1.0]hexane

IUPAC Name:

(1R,4R,5S)-4-methyl-1-(propan-2-yl)bicyclo[3.1.0]hexan-3-one; 1,3,3-trimethylbicyclo[2.2.1]heptan-2-one; 4-methylidene-1-(propan-2-yl)bicyclo[3.1.0]hexan-3-yl acetate; 4-methylidene-1-(propan-2-yl)bicyclo[3.1.0]hexane

Type of Substance

Composition:

UVCB

Origin:

organic

Substance Identifiers

EC number

294-870-0

CAS number

971770-83-1

Compositions

Boundary Composition(s)

Essential oil of Platycladus orientalis (L.) Franco obtained from branches and leaves by steam distillation followed by vacuum distillation

State Form:

liquid

Constituent 1

Reference substance name:

3,3-dimethyl-8,9-dinorbornan-2-one

EC Number:

214-804-6

EC Name:

3,3-dimethyl-8,9-dinorbornan-2-one

CAS Number:

1195-79-5

Molecular formula:

C10H16O

IUPAC Name:

1,3,3-trimethylbicyclo[2.2.1]heptan-2-one

Constituent 2

Reference substance name:

4-methylidene-1-propan-2-yl-3-bicyclo[3.1.0]hexanyl) acetate

CAS Number:

3536-54-7

Molecular formula:

C12H18O2

IUPAC Name:

4-methylidene-1-propan-2-yl-3-bicyclo[3.1.0]hexanyl) acetate

Constituent 3

Reference substance name:

(1S, 4S, 5R)-4-Methyl-1-(1-methylethyl)bicyclo[3.1.0]hexan-3-one

CAS Number:

471-15-8

Molecular formula:

C10H16O

IUPAC Name:

(1S, 4S, 5R)-4-Methyl-1-(1-methylethyl)bicyclo[3.1.0]hexan-3-one

Constituent 4

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:

1-isopropyl-4-methylenebicyclo[3.1.0]hexane

Constituent 5

Reference substance name:

1-isopropyl-4-methylbicyclo[3.1.0]hexan-3-one

EC Number:

208-912-2

EC Name:

1-isopropyl-4-methylbicyclo[3.1.0]hexan-3-one

CAS Number:

546-80-5

Molecular formula:

C10H16O

IUPAC Name:

(1S,4R,5R)-4-methyl-1-propan-2-ylbicyclo[3.1.0]hexan-3-one

Constituent 6

Reference substance name:

Humulene

EC Number:

229-816-7

EC Name:

Humulene

CAS Number:

6753-98-6

Molecular formula:

C15H24

IUPAC Name:

(1E,4E,8E)-2,6,6,9-tetramethylcycloundeca-1,4,8-triene

Constituent 7

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 8

Reference substance name:

Camphene

EC Number:

201-234-8

EC Name:

Camphene

CAS Number:

79-92-5

Molecular formula:

C10H16

IUPAC Name:

2,2-diméthyl-3-méthylène-bicyclo[2,2,1]heptane

Constituent 9

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:

2,6,6-trimethylbicyclo[3.1.1]hept-2-ene

Constituent 10

Reference substance name:

DL-borneol

EC Number:

208-080-0

EC Name:

DL-borneol

CAS Number:

507-70-0

Molecular formula:

C10H18O

IUPAC Name:

endo-1,7,7-trimethyl- bicyclo[2.2.1]heptan-2-ol

Constituent 11

Reference substance name:

p-mentha-1,4-diene

EC Number:

202-794-6

EC Name:

p-mentha-1,4-diene

CAS Number:

99-85-4

Molecular formula:

C10H16

IUPAC Name:

1-isopropyl-4-methylcyclohexa-1,4-diene

Constituent 12

Reference substance name:

Pin-2(10)-ene

EC Number:

204-872-5

EC Name:

Pin-2(10)-ene

CAS Number:

127-91-3

Molecular formula:

C10H16

IUPAC Name:

6,6-dimethyl-2-methylenebicyclo[3.1.1]heptane

Constituent 13

Reference substance name:

Dipentene

EC Number:

205-341-0

EC Name:

Dipentene

CAS Number:

138-86-3

Molecular formula:

C10H16

IUPAC Name:

4-isopropenyl-1-methylcyclohexene

Constituent 14

Reference substance name:

L-born-2-yl acetate

EC Number:

227-101-4

EC Name:

L-born-2-yl acetate

CAS Number:

5655-61-8

Molecular formula:

C12H20O2

IUPAC Name:

1,7,7-trimethylbicyclo[2.2.1]hept-2-yl acetate

Constituent 15

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 16

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 17

Reference substance name:

DL-bornan-2-one

EC Number:

244-350-4

EC Name:

DL-bornan-2-one

CAS Number:

21368-68-3

Molecular formula:

C10H16O

IUPAC Name:

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

Constituent 18

Reference substance name:

p-menth-1-en-4-ol

EC Number:

209-235-5

EC Name:

p-menth-1-en-4-ol

CAS Number:

562-74-3

Molecular formula:

C10H18O

IUPAC Name:

1-isopropyl-4-methylcyclohex-3-en-1-ol