Chem
J-GLOBAL ID：200907061950185286
Nikkaji number：J953.510A
(E)-5-Methyl-3-hexene-2-one
(E)-5-メチル-3-ヘキセン-2-オン
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
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
Molecular formula： C7H12O
Molecular formula furigana： C7-H12-O
Molecular weight： 112.172
InChI：
InChI=1S/C7H12O/c1-6(2)4-5-7(3)8/h4-6H,1-3H3/b5-4+
InChI key：
IYMKNYVCXUEFJE-SNAWJCMRSA-N
SMILES：
CC(C)/C=C/C(=O)C
Systematic name (4)：
- (E)-5-メチル-3-ヘキセン-2-オン
- (3E)-5-メチル-3-ヘキセン-2-オン
- (3E)-5-メチルヘキサ-3-エン-2-オン
- (3E)-5-methylhex-3-en-2-one
- (E)-5-Methyl-3-hexene-2-one
- (3E)-5-Methyl-3-hexene-2-one
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