Chem
J-GLOBAL ID：200907029363984140
Nikkaji number：J671.572I
4-Phenyl-4-oxobutanoic acid benzyl ester
4-フェニル-4-オキソブタン酸ベンジル
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： C17H16O3
Molecular formula furigana： C17-H16-O3
Molecular weight： 268.312
InChI：
InChI=1S/C17H16O3/c18-16(15-9-5-2-6-10-15)11-12-17(19)20-13-14-7-3-1-4-8-14/h1-10H,11-13H2
InChI key：
ROBFNYBWJKITEN-UHFFFAOYSA-N
SMILES：
O=C(CCC(=O)c1ccccc1)OCc1ccccc1
Systematic name (3)：
- 4-フェニル-4-オキソブタン酸ベンジル
- ベンジル 4-オキソ-4-フェニルブタノアート
- benzyl 4-oxo-4-phenylbutanoate
- 4-Phenyl-4-oxobutanoic acid benzyl ester
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