Chem
J-GLOBAL ID:200907074208611295   Nikkaji number:J1.145.416J

(2S,4S)-4-Phenyl-4-methoxy-2-(2,2-dimethylpropyl)butyric acid ethyl ester

(2S,4S)-4-フェニル-4-メトキシ-2-(2,2-ジメチルプロピル)酪酸エチル
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: C18H28O3
Molecular formula furigana: C18-H28-O3
Molecular weight: 292.419
InChI: InChI=1S/C18H28O3/c1-6-21-17(19)15(13-18(2,3)4)12-16(20-5)14-10-8-7-9-11-14/h7-11,15-16H,6,12-13H2,1-5H3/t15-,16+/m1/s1
InChI key: FXDRRARSFAPBGA-CVEARBPZSA-N
SMILES: CCOC(=O)[C@H](C[C@H](OC)c1ccccc1)CC(C)(C)C
Systematic name  (3):
  • (2S,4S)-4-フェニル-4-メトキシ-2-(2,2-ジメチルプロピル)酪酸エチル
  • エチル (2S)-2-[(2S)-2-メトキシ-2-フェニルエチル]-4,4-ジメチルペンタノアート
  • ethyl (2S)-2-[(2S)-2-methoxy-2-phenylethyl]-4,4-dimethylpentanoate
Other name (1):
  • (2S,4S)-4-Phenyl-4-methoxy-2-(2,2-dimethylpropyl)butyric acid ethyl ester
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