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Cyclohexanol, 2-[1-[[(4-methylphenyl)sulfonyl]methyl]pentylidene]-, (Z)-(.+-.)-
SpectraBase Compound ID 4Rl1SdW1aZx
InChI InChI=1S/C19H28O3S/c1-3-4-7-16(18-8-5-6-9-19(18)20)14-23(21,22)17-12-10-15(2)11-13-17/h10-13,19-20H,3-9,14H2,1-2H3/b18-16-
InChIKey MOKVFFBWMPVOOG-VLGSPTGOSA-N
Mol Weight 336.49 g/mol
Molecular Formula C19H28O3S
Exact Mass 336.175916 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 6rPTlfu2dSy
Name Cyclohexanol, 2-[1-[[(4-methylphenyl)sulfonyl]methyl]pentylidene]-, (Z)-(.+-.)-
Alternate Name(s) (2Z)-2-(1-{[(4-methylphenyl)sulfonyl]methyl}pentylidene)cyclohexanol
CAS Registry Number 127381-52-6
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C19H28O3S
InChI InChI=1S/C19H28O3S/c1-3-4-7-16(18-8-5-6-9-19(18)20)14-23(21,22)17-12-10-15(2)11-13-17/h10-13,19-20H,3-9,14H2,1-2H3/b18-16-
InChIKey MOKVFFBWMPVOOG-VLGSPTGOSA-N
Molecular Weight 336.490 g/mol
SMILES OC1\C(=C/(CS(c2ccc(cc2)C)(=O)=O)CCCC)CCCC1
SPLASH splash10-01vx-4900000000-43f135a4e834b7baa4e9
Source of Spectrum J-55-4601-30
Wiley ID 1332417