Chem
J-GLOBAL ID：200907070062840070   Nikkaji number：J1.676.965G

(2S)-2β-(3-Oxobutyl)-3α-methyl-6β-[(1R)-1-methyl-2-(formyloxy)ethyl]cyclohexanone

(2R)-2-[(1S,3S,4R)-4-メチル-2-オキソ-3-(3-オキソブチル)シクロヘキシル]プロピル ホルマート
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： C15H24O4
Molecular formula furigana： C15-H24-O4
Molecular weight： 268.353
InChI： InChI=1S/C15H24O4/c1-10-4-6-14(11(2)8-19-9-16)15(18)13(10)7-5-12(3)17/h9-11,13-14H,4-8H2,1-3H3/t10-,11+,13+,14+/m1/s1
InChI key： PHOZAQZIHUYNHM-XWUBHJNHSA-N
SMILES： C[C@@H](COC=O)[C@@H]1CC[C@@H](C)[C@H](CCC(=O)C)C1=O
Systematic name  (3)：
  • (2S)-2β-(3-オキソブチル)-3α-メチル-6β-[(1R)-1-メチル-2-(ホルミルオキシ)エチル]シクロヘキサノン
  • (2R)-2-[(1S,3S,4R)-4-メチル-2-オキソ-3-(3-オキソブチル)シクロヘキシル]プロピル ホルマート
  • (2R)-2-[(1S,3S,4R)-4-methyl-2-oxo-3-(3-oxobutyl)cyclohexyl]propyl formate
Other name (1)：
  • (2S)-2β-(3-Oxobutyl)-3α-methyl-6β-[(1R)-1-methyl-2-(formyloxy)ethyl]cyclohexanone
Thsaurus map：
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