Registration Dossier

Identification

Display Name:
Reference substance 001
Molecular formula:
Not applicable (UVCB)

Type of substance

Composition:
UVCB
Origin:
organic

Other names

Trade names:
Huile essentielle d'encens

Total tonnage band

Total range:
10 - 100 tonnes per annum

REACH

Registered as:
FULL
Submitted:
Joint Submission

Publication dates

First published:
30-Aug-2017
Last modified:
23-Sep-2019

Chemical safety assessment

Performed for this substance:
YES

Compositions open all close all

Type:
legal entity composition of the substance
State Form:
liquid


Constituent 1
Reference substance name:
not applicable
CAS Number:
not applicable
Molecular formula:
not applicable
IUPAC Name:
not applicable
Constituent 2
Reference substance name:
Tricyclo(4.4.0.0(2,7))decane, 1-methyl-3-methylene-8-(1-methylethyl)-, stereoisomer
CAS Number:
18252-44-3
Molecular formula:
C15 H24
IUPAC Name:
Tricyclo(4.4.0.0(2,7))decane, 1-methyl-3-methylene-8-(1-methylethyl)-, stereoisomer
Constituent 3
Chemical structure
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-ethenyl-1-methyl-2,4-di(prop-1-en-2-yl)cyclohexane
Constituent 4
Chemical structure
Reference substance name:
8-isopropyl-1,3-dimethyltricyclo[4.4.0.02,7]dec-3-ene
EC Number:
223-364-4
EC Name:
8-isopropyl-1,3-dimethyltricyclo[4.4.0.02,7]dec-3-ene
CAS Number:
3856-25-5
Molecular formula:
C15H24
IUPAC Name:
8-isopropyl-1,3-dimethyltricyclo[4.4.0.0~2,7~]dec-3-ene
Constituent 5
Chemical structure
Reference substance name:
Humulene
EC Number:
229-816-7
EC Name:
Humulene
CAS Number:
6753-98-6
Molecular formula:
C15H24
IUPAC Name:
2,6,6,9-tetramethylcycloundeca-1,4,8-triene
Constituent 6
Chemical structure
Reference substance name:
(1S,4S,4aR,8aR)-1,6-dimethyl-4-propan-2-yl-3,4,4a,7,8,8a-hexahydro-2H-naphthalen-1-ol
CAS Number:
5937-11-1
Molecular formula:
C15 H26 O
IUPAC Name:
(1S,4S,4aR,8aR)-1,6-dimethyl-4-propan-2-yl-3,4,4a,7,8,8a-hexahydro-2H-naphthalen-1-ol
Constituent 7
Reference substance name:
(1S,3Z,7E,11E)-4,8,12-trimethyl-1-propan-2-ylcyclotetradeca-3,7,11-trien-1-ol
CAS Number:
67814-27-1
Molecular formula:
C20 H34 O
IUPAC Name:
(1S,3Z,7E,11E)-4,8,12-trimethyl-1-propan-2-ylcyclotetradeca-3,7,11-trien-1-ol
Constituent 8
Chemical structure
Reference substance name:
[1R-(1R*,4R*,6R*,10S*)]-4,12,12-trimethyl-9-methylene-5-oxatricyclo[8.2.0.04,6]dodecane
EC Number:
214-519-7
EC Name:
[1R-(1R*,4R*,6R*,10S*)]-4,12,12-trimethyl-9-methylene-5-oxatricyclo[8.2.0.04,6]dodecane
CAS Number:
1139-30-6
Molecular formula:
C15H24O
IUPAC Name:
4,12,12-trimethyl-9-methylene-5-oxatricyclo[8.2.0.0~4,6~]dodecane
Constituent 9
Chemical structure
Reference substance name:
p-menth-1-en-8-ol
EC Number:
202-680-6
EC Name:
p-menth-1-en-8-ol
CAS Number:
98-55-5
Molecular formula:
C10H18O
IUPAC Name:
alpha,alpha-4-trimethyl-3-cyclohexene-1-methanol
Constituent 10
Chemical structure
Reference substance name:
3-octyl acetate
EC Number:
225-471-1
EC Name:
3-octyl acetate
CAS Number:
4864-61-3
Molecular formula:
C10H20O2
IUPAC Name:
octan-3-yl acetate
Constituent 11
Chemical structure
Reference substance name:
(1S,4aR,8aS)-4,7-dimethyl-1-propan-2-yl-1,2,4a,5,8,8a-hexahydronaphthalene
CAS Number:
523-47-7
Molecular formula:
C15H24
IUPAC Name:
(1S,4aR,8aS)-4,7-dimethyl-1-propan-2-yl-1,2,4a,5,8,8a-hexahydronaphthalene
Constituent 12
Chemical structure
Reference substance name:
7-methyl-4-methylidene-1-propan-2-yl-2,3,4a,5,6,8a-hexahydro-1H-naphthalene
CAS Number:
1460-97-5
Molecular formula:
C15H24
IUPAC Name:
7-methyl-4-methylidene-1-propan-2-yl-2,3,4a,5,6,8a-hexahydro-1H-naphthalene
Constituent 13
Chemical structure
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 14
Chemical structure
Reference substance name:
3,7,7-trimethylbicyclo[4.1.0]hept-3-ene
EC Number:
236-719-3
EC Name:
3,7,7-trimethylbicyclo[4.1.0]hept-3-ene
CAS Number:
13466-78-9
Molecular formula:
C10H16
IUPAC Name:
3,7,7-trimethylbicyclo[4.1.0]hept-3-ene
Constituent 15
Chemical structure
Reference substance name:
p-mentha-1,5-diene
EC Number:
202-792-5
EC Name:
p-mentha-1,5-diene
CAS Number:
99-83-2
Molecular formula:
C10H16
IUPAC Name:
5-isopropyl-2-methylcyclohexa-1,3-diene
Constituent 16
Chemical structure
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 17
Reference substance name:
Dimethyl ether
EC Number:
204-065-8
EC Name:
Dimethyl ether
CAS Number:
115-10-6
Molecular formula:
C2H6O
IUPAC Name:
Methoxymethane
Constituent 18
Chemical structure
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 19
Chemical structure
Reference substance name:
Caryophyllene
EC Number:
201-746-1
EC Name:
Caryophyllene
CAS Number:
87-44-5
Molecular formula:
C15H24
IUPAC Name:
(1R,4E,9S)-4,11,11-trimethyl-8-methylidenebicyclo[7.2.0]undec-4-ene
Constituent 20
Chemical structure
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 21
Chemical structure
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 22
Chemical structure
Reference substance name:
5-isopropyl-2-methylbicyclo[3.1.0]hex-2-ene
EC Number:
220-686-7
EC Name:
5-isopropyl-2-methylbicyclo[3.1.0]hex-2-ene
CAS Number:
2867-05-2
Molecular formula:
C10H16
IUPAC Name:
5-isopropyl-2-methylbicyclo[3.1.0]hex-2-ene
Constituent 23
Chemical structure
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 24
Chemical structure
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
Type:
legal entity composition of the substance
State Form:
liquid


Constituent 1
Reference substance name:
not applicable
CAS Number:
not applicable
Molecular formula:
not applicable
IUPAC Name:
not applicable
Constituent 2
Reference substance name:
Tricyclo(4.4.0.0(2,7))decane, 1-methyl-3-methylene-8-(1-methylethyl)-, stereoisomer
CAS Number:
18252-44-3
Molecular formula:
C15 H24
IUPAC Name:
Tricyclo(4.4.0.0(2,7))decane, 1-methyl-3-methylene-8-(1-methylethyl)-, stereoisomer
Constituent 3
Chemical structure
Reference substance name:
(1S)-4-methyl-1-propan-2-ylcyclohex-3-en-1-ol
CAS Number:
2438-10-0
Molecular formula:
C10H18O
IUPAC Name:
(1S)-4-methyl-1-propan-2-ylcyclohex-3-en-1-ol
Constituent 4
Chemical structure
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-ethenyl-1-methyl-2,4-di(prop-1-en-2-yl)cyclohexane
Constituent 5
Chemical structure
Reference substance name:
8-isopropyl-1,3-dimethyltricyclo[4.4.0.02,7]dec-3-ene
EC Number:
223-364-4
EC Name:
8-isopropyl-1,3-dimethyltricyclo[4.4.0.02,7]dec-3-ene
CAS Number:
3856-25-5
Molecular formula:
C15H24
IUPAC Name:
8-isopropyl-1,3-dimethyltricyclo[4.4.0.0~2,7~]dec-3-ene
Constituent 6
Chemical structure
Reference substance name:
Humulene
EC Number:
229-816-7
EC Name:
Humulene
CAS Number:
6753-98-6
Molecular formula:
C15H24
IUPAC Name:
2,6,6,9-tetramethylcycloundeca-1,4,8-triene
Constituent 7
Reference substance name:
(1S,4S,4aR,8aR)-1,6-dimethyl-4-propan-2-yl-3,4,4a,7,8,8a-hexahydro-2H-naphthalen-1-ol
CAS Number:
5937-11-1
Molecular formula:
C15 H26 O
IUPAC Name:
(1S,4S,4aR,8aR)-1,6-dimethyl-4-propan-2-yl-3,4,4a,7,8,8a-hexahydro-2H-naphthalen-1-ol
Constituent 8
Reference substance name:
(1S,3Z,7E,11E)-4,8,12-trimethyl-1-propan-2-ylcyclotetradeca-3,7,11-trien-1-ol
CAS Number:
67814-27-1
Molecular formula:
C20 H34 O
IUPAC Name:
(1S,3Z,7E,11E)-4,8,12-trimethyl-1-propan-2-ylcyclotetradeca-3,7,11-trien-1-ol
Constituent 9
Chemical structure
Reference substance name:
[1R-(1R*,4R*,6R*,10S*)]-4,12,12-trimethyl-9-methylene-5-oxatricyclo[8.2.0.04,6]dodecane
EC Number:
214-519-7
EC Name:
[1R-(1R*,4R*,6R*,10S*)]-4,12,12-trimethyl-9-methylene-5-oxatricyclo[8.2.0.04,6]dodecane
CAS Number:
1139-30-6
Molecular formula:
C15H24O
IUPAC Name:
4,12,12-trimethyl-9-methylene-5-oxatricyclo[8.2.0.0~4,6~]dodecane
Constituent 10
Chemical structure
Reference substance name:
p-menth-1-en-8-ol
EC Number:
202-680-6
EC Name:
p-menth-1-en-8-ol
CAS Number:
98-55-5
Molecular formula:
C10H18O
IUPAC Name:
alpha,alpha-4-trimethyl-3-cyclohexene-1-methanol
Constituent 11
Chemical structure
Reference substance name:
3-octyl acetate
EC Number:
225-471-1
EC Name:
3-octyl acetate
CAS Number:
4864-61-3
Molecular formula:
C10H20O2
IUPAC Name:
octan-3-yl acetate
Constituent 12
Chemical structure
Reference substance name:
(1S,4aR,8aS)-4,7-dimethyl-1-propan-2-yl-1,2,4a,5,8,8a-hexahydronaphthalene
CAS Number:
523-47-7
Molecular formula:
C15H24
IUPAC Name:
(1S,4aR,8aS)-4,7-dimethyl-1-propan-2-yl-1,2,4a,5,8,8a-hexahydronaphthalene
Constituent 13
Reference substance name:
7-methyl-4-methylidene-1-propan-2-yl-2,3,4a,5,6,8a-hexahydro-1H-naphthalene
CAS Number:
1460-97-5
Molecular formula:
C15H24
IUPAC Name:
7-methyl-4-methylidene-1-propan-2-yl-2,3,4a,5,6,8a-hexahydro-1H-naphthalene
Constituent 14
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 15
Chemical structure
Reference substance name:
3,7,7-trimethylbicyclo[4.1.0]hept-3-ene
EC Number:
236-719-3
EC Name:
3,7,7-trimethylbicyclo[4.1.0]hept-3-ene
CAS Number:
13466-78-9
Molecular formula:
C10H16
IUPAC Name:
3,7,7-trimethylbicyclo[4.1.0]hept-3-ene
Constituent 16
Chemical structure
Reference substance name:
p-mentha-1,5-diene
EC Number:
202-792-5
EC Name:
p-mentha-1,5-diene
CAS Number:
99-83-2
Molecular formula:
C10H16
IUPAC Name:
5-isopropyl-2-methylcyclohexa-1,3-diene
Constituent 17
Chemical structure
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 18
Reference substance name:
Dimethyl ether
EC Number:
204-065-8
EC Name:
Dimethyl ether
CAS Number:
115-10-6
Molecular formula:
C2H6O
IUPAC Name:
Methoxymethane
Constituent 19
Chemical structure
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 20
Chemical structure
Reference substance name:
Caryophyllene
EC Number:
201-746-1
EC Name:
Caryophyllene
CAS Number:
87-44-5
Molecular formula:
C15H24
IUPAC Name:
(1R,4E,9S)-4,11,11-trimethyl-8-methylidenebicyclo[7.2.0]undec-4-ene
Constituent 21
Chemical structure
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 22
Chemical structure
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 23
Chemical structure
Reference substance name:
5-isopropyl-2-methylbicyclo[3.1.0]hex-2-ene
EC Number:
220-686-7
EC Name:
5-isopropyl-2-methylbicyclo[3.1.0]hex-2-ene
CAS Number:
2867-05-2
Molecular formula:
C10H16
IUPAC Name:
5-isopropyl-2-methylbicyclo[3.1.0]hex-2-ene
Constituent 24
Chemical structure
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 25
Chemical structure
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
Type:
boundary composition of the substance
State Form:
liquid


Constituent 1
Reference substance name:
not applicable
CAS Number:
not applicable
Molecular formula:
not applicable
IUPAC Name:
not applicable
Constituent 2
Chemical structure
Reference substance name:
Tricyclo(4.4.0.0(2,7))decane, 1-methyl-3-methylene-8-(1-methylethyl)-, stereoisomer
CAS Number:
18252-44-3
Molecular formula:
C15 H24
IUPAC Name:
Tricyclo(4.4.0.0(2,7))decane, 1-methyl-3-methylene-8-(1-methylethyl)-, stereoisomer
Constituent 3
Chemical structure
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-ethenyl-1-methyl-2,4-di(prop-1-en-2-yl)cyclohexane
Constituent 4
Chemical structure
Reference substance name:
8-isopropyl-1,3-dimethyltricyclo[4.4.0.02,7]dec-3-ene
EC Number:
223-364-4
EC Name:
8-isopropyl-1,3-dimethyltricyclo[4.4.0.02,7]dec-3-ene
CAS Number:
3856-25-5
Molecular formula:
C15H24
IUPAC Name:
8-isopropyl-1,3-dimethyltricyclo[4.4.0.0~2,7~]dec-3-ene
Constituent 5
Chemical structure
Reference substance name:
Humulene
EC Number:
229-816-7
EC Name:
Humulene
CAS Number:
6753-98-6
Molecular formula:
C15H24
IUPAC Name:
2,6,6,9-tetramethylcycloundeca-1,4,8-triene
Constituent 6
Chemical structure
Reference substance name:
(1S,4S,4aR,8aR)-1,6-dimethyl-4-propan-2-yl-3,4,4a,7,8,8a-hexahydro-2H-naphthalen-1-ol
CAS Number:
5937-11-1
Molecular formula:
C15 H26 O
IUPAC Name:
(1S,4S,4aR,8aR)-1,6-dimethyl-4-propan-2-yl-3,4,4a,7,8,8a-hexahydro-2H-naphthalen-1-ol
Constituent 7
Chemical structure
Reference substance name:
(1S,3Z,7E,11E)-4,8,12-trimethyl-1-propan-2-ylcyclotetradeca-3,7,11-trien-1-ol
CAS Number:
67814-27-1
Molecular formula:
C20 H34 O
IUPAC Name:
(1S,3Z,7E,11E)-4,8,12-trimethyl-1-propan-2-ylcyclotetradeca-3,7,11-trien-1-ol
Constituent 8
Chemical structure
Reference substance name:
[1R-(1R*,4R*,6R*,10S*)]-4,12,12-trimethyl-9-methylene-5-oxatricyclo[8.2.0.04,6]dodecane
EC Number:
214-519-7
EC Name:
[1R-(1R*,4R*,6R*,10S*)]-4,12,12-trimethyl-9-methylene-5-oxatricyclo[8.2.0.04,6]dodecane
CAS Number:
1139-30-6
Molecular formula:
C15H24O
IUPAC Name:
4,12,12-trimethyl-9-methylene-5-oxatricyclo[8.2.0.0~4,6~]dodecane
Constituent 9
Chemical structure
Reference substance name:
p-menth-1-en-8-ol
EC Number:
202-680-6
EC Name:
p-menth-1-en-8-ol
CAS Number:
98-55-5
Molecular formula:
C10H18O
IUPAC Name:
alpha,alpha-4-trimethyl-3-cyclohexene-1-methanol
Constituent 10
Chemical structure
Reference substance name:
3-octyl acetate
EC Number:
225-471-1
EC Name:
3-octyl acetate
CAS Number:
4864-61-3
Molecular formula:
C10H20O2
IUPAC Name:
octan-3-yl acetate
Constituent 11
Chemical structure
Reference substance name:
(1S,4aR,8aS)-4,7-dimethyl-1-propan-2-yl-1,2,4a,5,8,8a-hexahydronaphthalene
CAS Number:
523-47-7
Molecular formula:
C15H24
IUPAC Name:
(1S,4aR,8aS)-4,7-dimethyl-1-propan-2-yl-1,2,4a,5,8,8a-hexahydronaphthalene
Constituent 12
Chemical structure
Reference substance name:
7-methyl-4-methylidene-1-propan-2-yl-2,3,4a,5,6,8a-hexahydro-1H-naphthalene
CAS Number:
1460-97-5
Molecular formula:
C15H24
IUPAC Name:
7-methyl-4-methylidene-1-propan-2-yl-2,3,4a,5,6,8a-hexahydro-1H-naphthalene
Constituent 13
Chemical structure
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 14
Chemical structure
Reference substance name:
3,7,7-trimethylbicyclo[4.1.0]hept-3-ene
EC Number:
236-719-3
EC Name:
3,7,7-trimethylbicyclo[4.1.0]hept-3-ene
CAS Number:
13466-78-9
Molecular formula:
C10H16
IUPAC Name:
3,7,7-trimethylbicyclo[4.1.0]hept-3-ene
Constituent 15
Chemical structure
Reference substance name:
p-mentha-1,5-diene
EC Number:
202-792-5
EC Name:
p-mentha-1,5-diene
CAS Number:
99-83-2
Molecular formula:
C10H16
IUPAC Name:
5-isopropyl-2-methylcyclohexa-1,3-diene
Constituent 16
Chemical structure
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 17
Chemical structure
Reference substance name:
1-methoxydecane
EC Number:
230-718-1
EC Name:
1-methoxydecane
CAS Number:
7289-52-3
Molecular formula:
C11H24O
IUPAC Name:
1-methoxydecane
Constituent 18
Chemical structure
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 19
Chemical structure
Reference substance name:
Caryophyllene
EC Number:
201-746-1
EC Name:
Caryophyllene
CAS Number:
87-44-5
Molecular formula:
C15H24
IUPAC Name:
(1R,4E,9S)-4,11,11-trimethyl-8-methylidenebicyclo[7.2.0]undec-4-ene
Constituent 20
Chemical structure
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 21
Chemical structure
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 22
Chemical structure
Reference substance name:
5-isopropyl-2-methylbicyclo[3.1.0]hex-2-ene
EC Number:
220-686-7
EC Name:
5-isopropyl-2-methylbicyclo[3.1.0]hex-2-ene
CAS Number:
2867-05-2
Molecular formula:
C10H16
IUPAC Name:
5-isopropyl-2-methylbicyclo[3.1.0]hex-2-ene
Constituent 23
Chemical structure
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 24
Chemical structure
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
Type:
legal entity composition of the substance
State Form:
liquid


Constituent 1
Reference substance name:
not applicable
CAS Number:
not applicable
Molecular formula:
not applicable
IUPAC Name:
not applicable
Constituent 2
Reference substance name:
Tricyclo(4.4.0.0(2,7))decane, 1-methyl-3-methylene-8-(1-methylethyl)-, stereoisomer
CAS Number:
18252-44-3
Molecular formula:
C15 H24
IUPAC Name:
Tricyclo(4.4.0.0(2,7))decane, 1-methyl-3-methylene-8-(1-methylethyl)-, stereoisomer
Constituent 3
Chemical structure
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-ethenyl-1-methyl-2,4-di(prop-1-en-2-yl)cyclohexane
Constituent 4
Chemical structure
Reference substance name:
8-isopropyl-1,3-dimethyltricyclo[4.4.0.02,7]dec-3-ene
EC Number:
223-364-4
EC Name:
8-isopropyl-1,3-dimethyltricyclo[4.4.0.02,7]dec-3-ene
CAS Number:
3856-25-5
Molecular formula:
C15H24
IUPAC Name:
8-isopropyl-1,3-dimethyltricyclo[4.4.0.0~2,7~]dec-3-ene
Constituent 5
Chemical structure
Reference substance name:
Humulene
EC Number:
229-816-7
EC Name:
Humulene
CAS Number:
6753-98-6
Molecular formula:
C15H24
IUPAC Name:
2,6,6,9-tetramethylcycloundeca-1,4,8-triene
Constituent 6
Chemical structure
Reference substance name:
(1S,4S,4aR,8aR)-1,6-dimethyl-4-propan-2-yl-3,4,4a,7,8,8a-hexahydro-2H-naphthalen-1-ol
CAS Number:
5937-11-1
Molecular formula:
C15 H26 O
IUPAC Name:
(1S,4S,4aR,8aR)-1,6-dimethyl-4-propan-2-yl-3,4,4a,7,8,8a-hexahydro-2H-naphthalen-1-ol
Constituent 7
Reference substance name:
(1S,3Z,7E,11E)-4,8,12-trimethyl-1-propan-2-ylcyclotetradeca-3,7,11-trien-1-ol
CAS Number:
67814-27-1
Molecular formula:
C20 H34 O
IUPAC Name:
(1S,3Z,7E,11E)-4,8,12-trimethyl-1-propan-2-ylcyclotetradeca-3,7,11-trien-1-ol
Constituent 8
Chemical structure
Reference substance name:
[1R-(1R*,4R*,6R*,10S*)]-4,12,12-trimethyl-9-methylene-5-oxatricyclo[8.2.0.04,6]dodecane
EC Number:
214-519-7
EC Name:
[1R-(1R*,4R*,6R*,10S*)]-4,12,12-trimethyl-9-methylene-5-oxatricyclo[8.2.0.04,6]dodecane
CAS Number:
1139-30-6
Molecular formula:
C15H24O
IUPAC Name:
4,12,12-trimethyl-9-methylene-5-oxatricyclo[8.2.0.0~4,6~]dodecane
Constituent 9
Chemical structure
Reference substance name:
p-menth-1-en-8-ol
EC Number:
202-680-6
EC Name:
p-menth-1-en-8-ol
CAS Number:
98-55-5
Molecular formula:
C10H18O
IUPAC Name:
alpha,alpha-4-trimethyl-3-cyclohexene-1-methanol
Constituent 10
Chemical structure
Reference substance name:
3-octyl acetate
EC Number:
225-471-1
EC Name:
3-octyl acetate
CAS Number:
4864-61-3
Molecular formula:
C10H20O2
IUPAC Name:
octan-3-yl acetate
Constituent 11
Chemical structure
Reference substance name:
(1S,4aR,8aS)-4,7-dimethyl-1-propan-2-yl-1,2,4a,5,8,8a-hexahydronaphthalene
CAS Number:
523-47-7
Molecular formula:
C15H24
IUPAC Name:
(1S,4aR,8aS)-4,7-dimethyl-1-propan-2-yl-1,2,4a,5,8,8a-hexahydronaphthalene
Constituent 12
Reference substance name:
7-methyl-4-methylidene-1-propan-2-yl-2,3,4a,5,6,8a-hexahydro-1H-naphthalene
CAS Number:
1460-97-5
Molecular formula:
C15H24
IUPAC Name:
7-methyl-4-methylidene-1-propan-2-yl-2,3,4a,5,6,8a-hexahydro-1H-naphthalene
Constituent 13
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 14
Chemical structure
Reference substance name:
3,7,7-trimethylbicyclo[4.1.0]hept-3-ene
EC Number:
236-719-3
EC Name:
3,7,7-trimethylbicyclo[4.1.0]hept-3-ene
CAS Number:
13466-78-9
Molecular formula:
C10H16
IUPAC Name:
3,7,7-trimethylbicyclo[4.1.0]hept-3-ene
Constituent 15
Chemical structure
Reference substance name:
p-mentha-1,5-diene
EC Number:
202-792-5
EC Name:
p-mentha-1,5-diene
CAS Number:
99-83-2
Molecular formula:
C10H16
IUPAC Name:
5-isopropyl-2-methylcyclohexa-1,3-diene
Constituent 16
Chemical structure
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 17
Reference substance name:
Dimethyl ether
EC Number:
204-065-8
EC Name:
Dimethyl ether
CAS Number:
115-10-6
Molecular formula:
C2H6O
IUPAC Name:
Methoxymethane
Constituent 18
Chemical structure
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 19
Chemical structure
Reference substance name:
Caryophyllene
EC Number:
201-746-1
EC Name:
Caryophyllene
CAS Number:
87-44-5
Molecular formula:
C15H24
IUPAC Name:
(1R,4E,9S)-4,11,11-trimethyl-8-methylidenebicyclo[7.2.0]undec-4-ene
Constituent 20
Chemical structure
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 21
Chemical structure
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 22
Chemical structure
Reference substance name:
5-isopropyl-2-methylbicyclo[3.1.0]hex-2-ene
EC Number:
220-686-7
EC Name:
5-isopropyl-2-methylbicyclo[3.1.0]hex-2-ene
CAS Number:
2867-05-2
Molecular formula:
C10H16
IUPAC Name:
5-isopropyl-2-methylbicyclo[3.1.0]hex-2-ene
Constituent 23
Chemical structure
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 24
Chemical structure
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
Type:
legal entity composition of the substance
State Form:
liquid


Constituent 1
Reference substance name:
Tricyclo(4.4.0.0(2,7))decane, 1-methyl-3-methylene-8-(1-methylethyl)-, stereoisomer
CAS Number:
18252-44-3
Molecular formula:
C15 H24
IUPAC Name:
Tricyclo(4.4.0.0(2,7))decane, 1-methyl-3-methylene-8-(1-methylethyl)-, stereoisomer
Constituent 2
Chemical structure
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-ethenyl-1-methyl-2,4-di(prop-1-en-2-yl)cyclohexane
Constituent 3
Chemical structure
Reference substance name:
8-isopropyl-1,3-dimethyltricyclo[4.4.0.02,7]dec-3-ene
EC Number:
223-364-4
EC Name:
8-isopropyl-1,3-dimethyltricyclo[4.4.0.02,7]dec-3-ene
CAS Number:
3856-25-5
Molecular formula:
C15H24
IUPAC Name:
8-isopropyl-1,3-dimethyltricyclo[4.4.0.0~2,7~]dec-3-ene
Constituent 4
Chemical structure
Reference substance name:
Humulene
EC Number:
229-816-7
EC Name:
Humulene
CAS Number:
6753-98-6
Molecular formula:
C15H24
IUPAC Name:
2,6,6,9-tetramethylcycloundeca-1,4,8-triene
Constituent 5
Chemical structure
Reference substance name:
(1S,4S,4aR,8aR)-1,6-dimethyl-4-propan-2-yl-3,4,4a,7,8,8a-hexahydro-2H-naphthalen-1-ol
CAS Number:
5937-11-1
Molecular formula:
C15 H26 O
IUPAC Name:
(1S,4S,4aR,8aR)-1,6-dimethyl-4-propan-2-yl-3,4,4a,7,8,8a-hexahydro-2H-naphthalen-1-ol
Constituent 6
Reference substance name:
(1S,3Z,7E,11E)-4,8,12-trimethyl-1-propan-2-ylcyclotetradeca-3,7,11-trien-1-ol
CAS Number:
67814-27-1
Molecular formula:
C20 H34 O
IUPAC Name:
(1S,3Z,7E,11E)-4,8,12-trimethyl-1-propan-2-ylcyclotetradeca-3,7,11-trien-1-ol
Constituent 7
Chemical structure
Reference substance name:
[1R-(1R*,4R*,6R*,10S*)]-4,12,12-trimethyl-9-methylene-5-oxatricyclo[8.2.0.04,6]dodecane
EC Number:
214-519-7
EC Name:
[1R-(1R*,4R*,6R*,10S*)]-4,12,12-trimethyl-9-methylene-5-oxatricyclo[8.2.0.04,6]dodecane
CAS Number:
1139-30-6
Molecular formula:
C15H24O
IUPAC Name:
4,12,12-trimethyl-9-methylene-5-oxatricyclo[8.2.0.0~4,6~]dodecane
Constituent 8
Chemical structure
Reference substance name:
p-menth-1-en-8-ol
EC Number:
202-680-6
EC Name:
p-menth-1-en-8-ol
CAS Number:
98-55-5
Molecular formula:
C10H18O
IUPAC Name:
alpha,alpha-4-trimethyl-3-cyclohexene-1-methanol
Constituent 9
Chemical structure
Reference substance name:
3-octyl acetate
EC Number:
225-471-1
EC Name:
3-octyl acetate
CAS Number:
4864-61-3
Molecular formula:
C10H20O2
IUPAC Name:
octan-3-yl acetate
Constituent 10