Chem
J-GLOBAL ID：200907008207981843   Nikkaji number：J725.322B

3β-(Phenylthio)cyclohexanone

3β-(フェニルチオ)シクロヘキサノン
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： C12H14OS
Molecular formula furigana： C12-H14-O-S
Molecular weight： 206.300
InChI： InChI=1S/C12H14OS/c13-10-5-4-8-12(9-10)14-11-6-2-1-3-7-11/h1-3,6-7,12H,4-5,8-9H2/t12-/m0/s1
InChI key： ODZCHNYVOXNEKZ-LBPRGKRZSA-N
SMILES： O=C1CCC[C@@H](C1)Sc1ccccc1
Systematic name  (7)：
  • (S)-3-(フェニルチオ)シクロヘキサノン
  • 3β-(フェニルチオ)シクロヘキサノン
  • (3S)-3-(フェニルチオ)シクロヘキサノン
  • (S)-3β-(フェニルチオ)シクロヘキサノン
  • (S)-3-(フェニルチオ)-1-シクロヘキサノン
Show all
Other name (5)：
  • (S)-3-(Phenylthio)cyclohexanone
  • 3β-(Phenylthio)cyclohexanone
  • (3S)-3-(Phenylthio)cyclohexanone
  • (S)-3β-(Phenylthio)cyclohexanone
  • (S)-3-(Phenylthio)-1-cyclohexanone
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