Chem
J-GLOBAL ID:200907050540637641   Nikkaji number:J684.373E

5-Ethynyl-6-methyl-3β-acetoxy-5-cyclohexene-1α-ol

5-エチニル-6-メチル-3β-アセトキシ-5-シクロヘキセン-1α-オール
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: C11H14O3
Molecular formula furigana: C11-H14-O3
Molecular weight: 194.230
InChI: InChI=1S/C11H14O3/c1-4-9-5-10(14-8(3)12)6-11(13)7(9)2/h1,10-11,13H,5-6H2,2-3H3/t10-,11+/m0/s1
InChI key: AEQAHUJUJFRGQZ-WDEREUQCSA-N
SMILES: CC(=O)O[C@@H]1C[C@@H](O)C(=C(C1)C#C)C
Systematic name  (4):
  • 酢酸(1S)-3-エチニル-4-メチル-5α-ヒドロキシ-3-シクロヘキセニル
  • 5-エチニル-6-メチル-3β-アセトキシ-5-シクロヘキセン-1α-オール
  • (1S,5R)-3-エチニル-5-ヒドロキシ-4-メチルシクロヘキサ-3-エン-1-イル アセタート
  • (1S,5R)-3-ethynyl-5-hydroxy-4-methylcyclohex-3-en-1-yl acetate
Other name (2):
  • Acetic acid (1S)-3-ethynyl-4-methyl-5α-hydroxy-3-cyclohexenyl ester
  • 5-Ethynyl-6-methyl-3β-acetoxy-5-cyclohexene-1α-ol
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