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Reference substances

Reference substances

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General information

Inventory

EC number:
204-872-5
EC name:
Pin-2(10)-ene
CAS number:
127-91-3

No inventory information available

Reference substance information

IUPAC name:
(1S,5S)-6,6-dimethyl-2-methylenebicyclo[3.1.1]heptane
Synonyms
Names:
(-)-beta pinene
(-)-beta-pinene
(-)-pin-2(10)-ene
l-beta-pinene
Identifier:
CAS number
127-91-3
Identifier:
IUPAC name
6,6-Dimethyl-2-methylenebicyclo[3.1.1]heptane
Identifier:
IUPAC name
6,6-dimethyl-2-methylenebicyclo[3.1.1]heptane
Identifier:
common name
Beta-pinene
Identifier:
other: SMILES notation
C(C(CC1C2)C1(C)C)(C2)=C
Identifier:
other: Molecular formula
C10H16
Identifier:
other: InChl
InChI=1/C10H16/c1-7-4-5-8-6-9(7)10(8,2)3/h8-9H,1,4-6H2,2-3H3

CAS information

CAS number:
18172-67-3

Molecular and structural information

Molecular formula:
C10H16
Molecular weight:
ca. 136.24
SMILES notation:
C1(CC[C@@H]2C([C@H]1C2)(C)C)=C
InChl:
1S/C10H16/c1-7-4-5-8-6-9(7)10(8,2)3/h8-9H,1,4-6H2,2-3H3/t8-,9-/m0/s1
Structural formula:
Chemical structure