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cis and trans-4(1,1-dimethylethyl)-1-[2-((4-methylphenyl)sulfonyl)-1-oxoethyl]-1-(2-propen-1-yl)cyclohexane
SpectraBase Compound ID 1reBwBSSCMr
InChI InChI=1S/C22H32O3S/c1-6-13-22(14-11-18(12-15-22)21(3,4)5)20(23)16-26(24,25)19-9-7-17(2)8-10-19/h6-10,18H,1,11-16H2,2-5H3/t18-,22-
InChIKey WDDWPIBLSSPVNA-LBZQVFOQSA-N
Mol Weight 376.6 g/mol
Molecular Formula C22H32O3S
Exact Mass 376.207216 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID HKF2tKxJXej
Name cis and trans-4(1,1-dimethylethyl)-1-[2-((4-methylphenyl)sulfonyl)-1-oxoethyl]-1-(2-propen-1-yl)cyclohexane
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Formula C22H32O3S
InChI InChI=1S/C22H32O3S/c1-6-13-22(14-11-18(12-15-22)21(3,4)5)20(23)16-26(24,25)19-9-7-17(2)8-10-19/h6-10,18H,1,11-16H2,2-5H3/t18-,22-
InChIKey WDDWPIBLSSPVNA-LBZQVFOQSA-N
Molecular Weight 376.555 g/mol
SMILES C(S(c1ccc(cc1)C)(=O)=O)C([C@]1(CC[C@](C(C)(C)C)(CC1)[H])CC=C)=O
SPLASH splash10-0a4l-9310000000-d987c7d4116f394b772d
Source of Spectrum C-111-8891-3
Synonyms 1-(1-allyl-4-tert-butylcyclohexyl)-2-[(4-methylphenyl)sulfonyl]ethanone
Wiley ID 1357848