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Diss Factsheets

Identification

Chemical structure
Display Name:
{1H,4H,5H,6H,7H,8H,9H,10H,11H,12H,13H-cyclopenta[12]annulen-2-yl}methane
EC Number:
941-253-5
CAS Number:
1689576-41-7
Molecular formula:
C16H26
IUPAC Name:
{1H,4H,5H,6H,7H,8H,9H,10H,11H,12H,13H-cyclopenta[12]annulen-2-yl}methane

Type of Substance

Composition:
UVCB
Origin:
organic

Substance Identifiers open all close all

BI000000657492
(No other type specified)

Compositions

Boundary Composition(s) open all close all

State Form:
liquid


Constituent 1
Chemical structure
Reference substance name:
(3aE)-2-methyl-5,6,7,8,9,10,11,12,13,13a-decahydro-1H-cyclopenta[12]annulene
Molecular formula:
C16H26
IUPAC Name:
(3aE)-2-methyl-5,6,7,8,9,10,11,12,13,13a-decahydro-1H-cyclopenta[12]annulene
Constituent 2
Chemical structure
Reference substance name:
2-methyl-4,5,6,7,8,9,10,11,12,13-decahydro-1H-cyclopenta[12]annulene
CAS Number:
77146-09-9
Molecular formula:
C16H26
IUPAC Name:
2-methyl-4,5,6,7,8,9,10,11,12,13-decahydro-1H-cyclopenta[12]annulene
Constituent 3
Chemical structure
Reference substance name:
(13Z)-2-methyl-2,4,5,6,7,8,9,10,11,12-decahydro-1H-cyclopenta[12]annulene
CAS Number:
89328-71-2
Molecular formula:
C16H26
IUPAC Name:
(13Z)-2-methyl-2,4,5,6,7,8,9,10,11,12-decahydro-1H-cyclopenta[12]annulene
Constituent 4
Chemical structure
Reference substance name:
(13E)-2-methyl-3a,4,5,6,7,8,9,10,11,12-decahydro-1H-cyclopenta[12]annulene
CAS Number:
89328-72-3
Molecular formula:
C16H26
IUPAC Name:
(13E)-2-methyl-3a,4,5,6,7,8,9,10,11,12-decahydro-1H-cyclopenta[12]annulene
Constituent 5
Chemical structure
Reference substance name:
(12E)-2-methyl-2,3,4,5,6,7,8,9,10,11-decahydro-1H-cyclopenta[12]annulene
Molecular formula:
C16H26
IUPAC Name:
(12E)-2-methyl-2,3,4,5,6,7,8,9,10,11-decahydro-1H-cyclopenta[12]annulene
Constituent 6
Chemical structure
Reference substance name:
(13Z)-2-methyl-3a,4,5,6,7,8,9,10,11,12-decahydro-1H-cyclopenta[12]annulene
Molecular formula:
C16H26
IUPAC Name:
(13Z)-2-methyl-3a,4,5,6,7,8,9,10,11,12-decahydro-1H-cyclopenta[12]annulene
Constituent 7
Chemical structure
Reference substance name:
2-methyl-2,3,4,5,6,7,8,9,10,11,12,13-dodecahydro-1H-cyclopenta[12]annulene
EC Number:
606-858-8
CAS Number:
21890-09-5
Molecular formula:
C16 H28
IUPAC Name:
2-methyl-2,3,4,5,6,7,8,9,10,11,12,13-dodecahydro-1H-cyclopenta[12]annulene
Constituent 8
Chemical structure
Reference substance name:
(1RS,11RS)-12,12-dimethylbicyclo[9.2.1]tetradecan-14-one
Molecular formula:
C16H28O
IUPAC Name:
(1RS,11RS)-12,12-dimethylbicyclo[9.2.1]tetradecan-14-one
Constituent 9
Chemical structure
Reference substance name:
(2Z)-2-(2-methylpropylidene)cyclododecanone
CAS Number:
1888389-99-8
Molecular formula:
C16H28O
IUPAC Name:
(2Z)-2-(2-methylpropylidene)cyclododecanone
Constituent 10
Chemical structure
Reference substance name:
2-(2-methyl-1-propen-1-yl)cyclododecanone
CAS Number:
134381-40-1
Molecular formula:
C16H28O
IUPAC Name:
2-(2-methyl-1-propen-1-yl)cyclododecanone
Constituent 11
Chemical structure
Reference substance name:
Mixture of 2-(2-methyl-2-propen-1-yl)cyclododecanone and (1RS,11SR)-12,12-dimethylbicyclo[9.2.1]tetradecan-14-one
Molecular formula:
C16H28O
IUPAC Name:
Mixture of 2-(2-methyl-2-propen-1-yl)cyclododecanone and (1RS,11SR)-12,12-dimethylbicyclo[9.2.1]tetradecan-14-one
Constituent 12
Reference substance name:
Unknown constituents
IUPAC Name:
Unknown constituents
State Form:
liquid


Constituent 1
Reference substance name:
non-specified impurities
Molecular formula:
non-specified impurities
IUPAC Name:
non-specified impurities
Constituent 2
Chemical structure
Reference substance name:
Cyclododecanone
EC Number:
212-595-6
EC Name:
Cyclododecanone
CAS Number:
830-13-7
Molecular formula:
C12H22O
IUPAC Name:
cyclododecanone
Constituent 3
Chemical structure
Reference substance name:
2-(2-Methyl-2-propenyl)cyclododecan-1-one
EC Number:
691-657-8
CAS Number:
62599-49-9
Molecular formula:
C16 H28 O
IUPAC Name:
2-(2-Methyl-2-propenyl)cyclododecan-1-one
Constituent 4
Chemical structure
Reference substance name:
Reference substance 001
CAS Number:
1224165-38-1
Molecular formula:
C16 H30 O
Constituent 5
Chemical structure
Reference substance name:
2-Methyl-4,5,6,7,8,9,10,11,12,13-decahydro-1H-cyclopentacyclo-dodecene
CAS Number:
77146-09-9
Molecular formula:
C16 H26
IUPAC Name:
2-Methyl-4,5,6,7,8,9,10,11,12,13-decahydro-1H-cyclopentacyclo-dodecene

Legal Entity Composition(s) open all close all

State Form:
liquid


Constituent 1
Chemical structure
Reference substance name:
(3aE)-2-methyl-5,6,7,8,9,10,11,12,13,13a-decahydro-1H-cyclopenta[12]annulene
Molecular formula:
C16H26
IUPAC Name:
(3aE)-2-methyl-5,6,7,8,9,10,11,12,13,13a-decahydro-1H-cyclopenta[12]annulene
Constituent 2
Chemical structure
Reference substance name:
2-methyl-4,5,6,7,8,9,10,11,12,13-decahydro-1H-cyclopenta[12]annulene
CAS Number:
77146-09-9
Molecular formula:
C16H26
IUPAC Name:
2-methyl-4,5,6,7,8,9,10,11,12,13-decahydro-1H-cyclopenta[12]annulene
Constituent 3