Chem
J-GLOBAL ID:200907051584616079   Nikkaji number:J70.890I

[R,(+)]-β-Hydroxy-β-isopropylhydrocinnamic acid methyl ester

[R,(+)]-β-ヒドロキシ-β-イソプロピルヒドロけい皮酸メチル
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: C13H18O3
Molecular formula furigana: C13-H18-O3
Molecular weight: 222.284
InChI: InChI=1S/C13H18O3/c1-10(2)13(15,9-12(14)16-3)11-7-5-4-6-8-11/h4-8,10,15H,9H2,1-3H3/t13-/m1/s1
InChI key: RKFPPNPCDIMSLL-CYBMUJFWSA-N
SMILES: COC(=O)C[C@@](O)(C(C)C)c1ccccc1
Systematic name  (4):
  • [R,(+)]-3-ヒドロキシ-4-メチル-3-フェニル吉草酸メチル
  • [R,(+)]-β-ヒドロキシ-β-イソプロピルヒドロけい皮酸メチル
  • メチル (3R)-3-ヒドロキシ-4-メチル-3-フェニルペンタノアート
  • methyl (3R)-3-hydroxy-4-methyl-3-phenylpentanoate
Other name (2):
  • [R,(+)]-β-Hydroxy-β-isopropylhydrocinnamic acid methyl ester
  • [R,(+)]-3-Hydroxy-4-methyl-3-phenylvaleric acid methyl ester
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