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Reference substances

Reference substances

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General information

Inventory

EC number:
229-816-7
EC name:
Humulene
CAS number:
6753-98-6

No inventory information available

Reference substance information

IUPAC name:
2,6,6,9-tetramethylcycloundeca-1,4,8-triene
Synonyms
Names:
(.+-.)-.alpha.-Humulene
.alpha.-Caryophyllene
.alpha.-Humulene (6CI, 7CI)
1,4,8-Cycloundecatriene, 2,6,6,9-tetramethyl-, (E,E,E)- (8CI)
Humulene
alpha-Caryophyllene
alpha-Humulene

CAS information

CAS number:
6753-98-6

Molecular and structural information

Molecular formula:
C15H24
Molecular weight:
204.351
SMILES notation:
CC1=CCC(C=CCC(=CCC1)C)(C)C
InChl:
InChI=1/C15H24/c1-13-7-5-8-14(2)10-12-15(3,4)11-6-9-13/h6-7,10-11H,5,8-9,12H2,1-4H3
Structural formula:
Chemical structure