Chem
J-GLOBAL ID:200907033356810592
Nikkaji number:J118.171H
(Z)-3-Hexenyl hexanoate
ヘキサン酸(Z)-3-ヘキセニル
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Substance type:
Substance type
Substance type classified into 3 categories. Decided structure: Substances with a clear structure Undicided Structure: Substances with unknown or undetermined structure Mixtures: Mixtures, racemic compounds, or compounds with relative structural arrangements
Decided structure
Molecular formula:
C12 H22 O2
Molecular formula furigana:
C12-H22-O2
Molecular weight:
198.306
InChI:
InChI=1S/C12H22O2/c1-3-5-7-9-11-14-12(13)10-8-6-4-2/h5,7H,3-4,6,8-11H2,1-2H3/b7-5-
InChI key:
RGACQXBDYBCJCY-ALCCZGGFSA-N
SMILES:
CCCCCC(=O)OCC/C=C\CC
Systematic name (7):
Other name (9):
cis-β-ヘキセニルカプロアート
cis-β-Hexenyl caproate
cis-3-Hexenyl caproate
Caproic acid (Z)-3-hexenyl ester
Hexanoic acid (Z)-3-hexen-1-yl ester
Caproic acid (Z)-3-hexen-1-yl ester
Hexanoic acid (Z)-3-hexenyl ester
(Z)-3-Hexenyl hexanoate
(Z)-3-Hexen-1-ol hexanoate
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CAS registry number:
31501-11-8
Regulation number (4):
(2)-760
EINECS2506616
TSCA(31501-11-8)
(2)-762
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