Chem
J-GLOBAL ID：200907012944658058
Nikkaji number：J2.153.733K
(2S,4S)-Pamplefleur
(2S,4S)-パンプレフロイル
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： C12H18O
Molecular formula furigana： C12-H18-O
Molecular weight： 178.275
InChI：
InChI=1S/C12H18O/c1-10(9-13)8-11(2)12-6-4-3-5-7-12/h3-7,10-11,13H,8-9H2,1-2H3/t10-,11-/m0/s1
InChI key：
SXGYZCMGVZKIPJ-QWRGUYRKSA-N
SMILES：
C[C@H](CO)C[C@H](C)c1ccccc1
Systematic name (3)：
- (2S,4S)-2-メチル-4-フェニル-1-ペンタノール
- (2S,4S)-2-メチル-4-フェニルペンタン-1-オール
- (2S,4S)-2-methyl-4-phenylpentan-1-ol
- (2S,4S)-2-Methyl-4-phenyl-1-pentanol
- (2S,4S)-Pamplefleur
- (2S,4S)-パンプレフロイル
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