Chem
J-GLOBAL ID：200907071391090003
Nikkaji number：J1.931.687D
(S)-1,3-Diphenyl-6-methyl-5-heptene-1-one
(S)-1,3-ジフェニル-6-メチル-5-ヘプテン-1-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： C20H22O
Molecular formula furigana： C20-H22-O
Molecular weight： 278.395
InChI：
InChI=1S/C20H22O/c1-16(2)13-14-19(17-9-5-3-6-10-17)15-20(21)18-11-7-4-8-12-18/h3-13,19H,14-15H2,1-2H3/t19-/m0/s1
InChI key：
LMDIHWRGUHIEOX-IBGZPJMESA-N
SMILES：
CC(=CC[C@@H](CC(=O)c1ccccc1)c1ccccc1)C
Systematic name (3)：
- (S)-1,3-ジフェニル-6-メチル-5-ヘプテン-1-オン
- (3S)-6-メチル-1,3-ジフェニルヘプタ-5-エン-1-オン
- (3S)-6-methyl-1,3-diphenylhept-5-en-1-one
- (S)-1,3-Diphenyl-6-methyl-5-heptene-1-one
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