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(S)-3-(Benzenesulfonyl)-4-methylcyclohex-2-en-1-one
SpectraBase Compound ID 54KuC37u5g3
InChI InChI=1S/C13H14O3S/c1-10-7-8-11(14)9-13(10)17(15,16)12-5-3-2-4-6-12/h2-6,9-10H,7-8H2,1H3/t10-/m0/s1
InChIKey FQKGIELUJSSVLB-JTQLQIEISA-N
Mol Weight 250.31 g/mol
Molecular Formula C13H14O3S
Exact Mass 250.066365 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 1vCLFz0t2VC
Name (S)-3-(Benzenesulfonyl)-4-methylcyclohex-2-en-1-one
Comments Less than 3 mono-isotopic peaks
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Formula C13H14O3S
InChI InChI=1S/C13H14O3S/c1-10-7-8-11(14)9-13(10)17(15,16)12-5-3-2-4-6-12/h2-6,9-10H,7-8H2,1H3/t10-/m0/s1
InChIKey FQKGIELUJSSVLB-JTQLQIEISA-N
Molecular Weight 250.312 g/mol
SMILES C1(S(=O)(=O)c2ccccc2)=CC(=O)CC[C@@]1(C)[H]
SPLASH splash10-001i-9040000000-f782d0b2ca512a2a9389
Source of Spectrum C-124-11098-17a
Synonyms (4S)-3-(benzenesulfonyl)-4-methyl-1-cyclohex-2-enone (4S)-3-(benzenesulfonyl)-4-methylcyclohex-2-en-1-one (4S)-3-(benzenesulfonyl)-4-methyl-cyclohex-2-en-1-one (4S)-4-methyl-3-(phenylsulfonyl)cyclohex-2-en-1-one
Wiley ID 1700888