Chem
J-GLOBAL ID：200907002999708750
Nikkaji number：J2.768.023B
4β-Benzyl-4-(hydroxymethyl)-2-cyclopentene-1-one
4β-ベンジル-4-(ヒドロキシメチル)-2-シクロペンテン-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： C13H14O2
Molecular formula furigana： C13-H14-O2
Molecular weight： 202.253
InChI：
InChI=1S/C13H14O2/c14-10-13(7-6-12(15)9-13)8-11-4-2-1-3-5-11/h1-7,14H,8-10H2/t13-/m1/s1
InChI key：
DRXHENZQYUMLAW-CYBMUJFWSA-N
SMILES：
OC[C@]1(Cc2ccccc2)CC(=O)C=C1
Systematic name (3)：
- 4β-ベンジル-4-(ヒドロキシメチル)-2-シクロペンテン-1-オン
- (4R)-4-ベンジル-4-(ヒドロキシメチル)シクロペンタ-2-エン-1-オン
- (4R)-4-benzyl-4-(hydroxymethyl)cyclopent-2-en-1-one
- 4β-Benzyl-4-(hydroxymethyl)-2-cyclopentene-1-one
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