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(E)-2-(2-Oxocyclohexyl)methyl-1-propenyl phenyl sulfone
SpectraBase Compound ID IsXzZbNz4JB
InChI InChI=1S/C16H20O3S/c1-2-11-20(18,19)16-10-6-4-8-14(16)12-13-7-3-5-9-15(13)17/h2,4,6,8,10-11,13H,3,5,7,9,12H2,1H3/b11-2+
InChIKey XWTPAZIOEAROCF-BIIKFXOESA-N
Mol Weight 292.39 g/mol
Molecular Formula C16H20O3S
Exact Mass 292.113316 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 3maJ7LEPUkb
Name (E)-2-(2-Oxocyclohexyl)methyl-1-propenyl phenyl sulfone
Alternate Name(s) 2-{2-[(1E)-1-propenylsulfonyl]benzyl}cyclohexanone
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Formula C16H20O3S
InChI InChI=1S/C16H20O3S/c1-2-11-20(18,19)16-10-6-4-8-14(16)12-13-7-3-5-9-15(13)17/h2,4,6,8,10-11,13H,3,5,7,9,12H2,1H3/b11-2+
InChIKey XWTPAZIOEAROCF-BIIKFXOESA-N
Molecular Weight 292.393 g/mol
SMILES c1(S(\C=C\C)(=O)=O)c(CC2C(=O)CCCC2)cccc1
SPLASH splash10-0udi-1900000000-8d9ac4ad1674515bc13d
Source of Spectrum C-115-12339-15
Wiley ID 1295349