Chem
J-GLOBAL ID：200907065957012447   Nikkaji number：J1.810.227G

Benzenebutyric acid α-methylbenzyl ester

ベンゼン酪酸α-メチルベンジル
Substance type：
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
Molecular formula： C18H20O2
Molecular formula furigana： C18-H20-O2
Molecular weight： 268.356
InChI： InChI=1S/C18H20O2/c1-15(17-12-6-3-7-13-17)20-18(19)14-8-11-16-9-4-2-5-10-16/h2-7,9-10,12-13,15H,8,11,14H2,1H3
InChI key： PPBIRRUINGLZAM-UHFFFAOYSA-N
SMILES： CC(OC(=O)CCCc1ccccc1)c1ccccc1
Systematic name  (4)：
  • 4-フェニルブタン酸1-フェニルエチル
  • ベンゼン酪酸α-メチルベンジル
  • 1-フェニルエチル 4-フェニルブタノアート
  • 1-phenylethyl 4-phenylbutanoate
Other name (2)：
  • 4-Phenylbutanoic acid 1-phenylethyl ester
  • Benzenebutyric acid α-methylbenzyl ester
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