Chem
J-GLOBAL ID：200907012497877740
Nikkaji number：J544.316D
2α,6α-Dibenzylcyclohexanone
2α,6α-ジベンジルシクロヘキサノン
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/c21-20-18(14-16-8-3-1-4-9-16)12-7-13-19(20)15-17-10-5-2-6-11-17/h1-6,8-11,18-19H,7,12-15H2/t18-,19+
InChI key：
BCGXZKQRZAYEKC-KDURUIRLSA-N
SMILES：
O=C1[C@@H](Cc2ccccc2)CCC[C@H]1Cc1ccccc1
Systematic name (5)：
- 2α,6α-ジベンジルシクロヘキサノン
- (2S)-2α,6α-ジベンジルシクロヘキサノン
- (2R,6S)-2,6-ジベンジルシクロヘキサノン
- (2R,6S)-2,6-ジベンジルシクロヘキサン-1-オン
- (2R,6S)-2,6-dibenzylcyclohexan-1-one
- 2α,6α-Dibenzylcyclohexanone
- (2S)-2α,6α-Dibenzylcyclohexanone
- (2R,6S)-2,6-Dibenzylcyclohexanone
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