Chem
J-GLOBAL ID:200907016704312338   Nikkaji number:J1.102.858F

4-(2-Oxo-5-acetoxycyclohexyl)-2-butynoic acid methyl ester

4-(2-オキソ-5-アセトキシシクロヘキシル)-2-ブチン酸メチル
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: C13H16O5
Molecular formula furigana: C13-H16-O5
Molecular weight: 252.266
InChI: InChI=1S/C13H16O5/c1-9(14)18-11-6-7-12(15)10(8-11)4-3-5-13(16)17-2/h10-11H,4,6-8H2,1-2H3
InChI key: XKXWVQMANFMWGX-UHFFFAOYSA-N
SMILES: COC(=O)C#CCC1CC(CCC1=O)OC(=O)C
Systematic name  (3):
  • 4-(2-オキソ-5-アセトキシシクロヘキシル)-2-ブチン酸メチル
  • メチル 4-[5-(アセチルオキシ)-2-オキソシクロヘキシル]ブタ-2-イノアート
  • methyl 4-[5-(acetyloxy)-2-oxocyclohexyl]but-2-ynoate
Other name (1):
  • 4-(2-Oxo-5-acetoxycyclohexyl)-2-butynoic acid methyl ester
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