Chem
J-GLOBAL ID：200907063290537845   Nikkaji number：J1.712.578H

(3S)-2,2-Dimethyl-3-hydroxy-5-phenylpentanoic acid methyl ester

(3S)-2,2-ジメチル-3-ヒドロキシ-5-フェニルペンタン酸メチル
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： C14H20O3
Molecular formula furigana： C14-H20-O3
Molecular weight： 236.311
InChI： InChI=1S/C14H20O3/c1-14(2,13(16)17-3)12(15)10-9-11-7-5-4-6-8-11/h4-8,12,15H,9-10H2,1-3H3/t12-/m0/s1
InChI key： CBAMORLIFHEPLB-LBPRGKRZSA-N
SMILES： COC(=O)C(C)(C)[C@@H](O)CCc1ccccc1
Systematic name  (3)：
  • (3S)-2,2-ジメチル-3-ヒドロキシ-5-フェニルペンタン酸メチル
  • メチル (3S)-3-ヒドロキシ-2,2-ジメチル-5-フェニルペンタノアート
  • methyl (3S)-3-hydroxy-2,2-dimethyl-5-phenylpentanoate
Other name (1)：
  • (3S)-2,2-Dimethyl-3-hydroxy-5-phenylpentanoic acid methyl ester
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