Chem
J-GLOBAL ID：200907065791912606
Nikkaji number：J2.263.208F
(2S)-2-[(S)-Hydroxycyclohexylmethyl]-2,3-dihydro-1H-indene-1-one
(2S)-2-[(S)-ヒドロキシシクロヘキシルメチル]-2,3-ジヒドロ-1H-インデン-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： C16H20O2
Molecular formula furigana： C16-H20-O2
Molecular weight： 244.334
InChI：
InChI=1S/C16H20O2/c17-15(11-6-2-1-3-7-11)14-10-12-8-4-5-9-13(12)16(14)18/h4-5,8-9,11,14-15,17H,1-3,6-7,10H2/t14-,15-/m0/s1
InChI key：
HRNXIYWSBVTYOT-GJZGRUSLSA-N
SMILES：
O[C@H]([C@@H]1Cc2ccccc2C1=O)C1CCCCC1
Systematic name (3)：
- (2S)-2-[(S)-ヒドロキシシクロヘキシルメチル]-2,3-ジヒドロ-1H-インデン-1-オン
- (2S)-2-[(S)-シクロヘキシル(ヒドロキシ)メチル]-2,3-ジヒドロ-1H-インデン-1-オン
- (2S)-2-[(S)-cyclohexyl(hydroxy)methyl]-2,3-dihydro-1H-inden-1-one
- (2S)-2-[(S)-Hydroxycyclohexylmethyl]-2,3-dihydro-1H-indene-1-one
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