Chem
J-GLOBAL ID：200907089650278632   Nikkaji number：J142.434C

4α-Methyl-4-phenyl-2-cyclohexene-1-one

4α-メチル-4-フェニル-2-シクロヘキセン-1-オン
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： C13H14O
Molecular formula furigana： C13-H14-O
Molecular weight： 186.254
InChI： InChI=1S/C13H14O/c1-13(9-7-12(14)8-10-13)11-5-3-2-4-6-11/h2-7,9H,8,10H2,1H3/t13-/m1/s1
InChI key： NTASQMWLMVNJSS-CYBMUJFWSA-N
SMILES： C[C@@]1(CCC(=O)C=C1)c1ccccc1
Systematic name  (7)：
  • [S,(-)]-4-メチル-4-フェニル-2-シクロヘキセン-1-オン
  • (6S)-6α-フェニル-6-メチル-1-シクロヘキセン-3-オン
  • (S)-4β-フェニル-4-メチル-2-シクロヘキセン-1-オン
  • (4S)-4α-メチル-4-フェニル-2-シクロヘキセン-1-オン
  • 4α-メチル-4-フェニル-2-シクロヘキセン-1-オン
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Other name (5)：
  • [S,(-)]-4-Methyl-4-phenyl-2-cyclohexene-1-one
  • (6S)-6α-Phenyl-6-methyl-1-cyclohexene-3-one
  • (S)-4β-Phenyl-4-methyl-2-cyclohexene-1-one
  • (4S)-4α-Methyl-4-phenyl-2-cyclohexene-1-one
  • 4α-Methyl-4-phenyl-2-cyclohexene-1-one
CAS registry number： 53834-74-5
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