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(Z)-3-methyl-4-(p-tolylsulfonyl)-3-buten-1-ol
SpectraBase Compound ID Emw2HDu8xp4
InChI InChI=1S/C12H16O3S/c1-10-3-5-12(6-4-10)16(14,15)9-11(2)7-8-13/h3-6,9,13H,7-8H2,1-2H3/b11-9-
InChIKey JYAIWYGWQCHZQK-LUAWRHEFSA-N
Mol Weight 240.32 g/mol
Molecular Formula C12H16O3S
Exact Mass 240.082016 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 3ncEoYUv6tE
Name (Z)-3-methyl-4-(p-tolylsulfonyl)-3-buten-1-ol
Alternate Name(s) (3Z)-3-methyl-4-[(4-methylphenyl)sulfonyl]-3-buten-1-ol
CAS Registry Number 108817-63-6
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C12H16O3S
InChI InChI=1S/C12H16O3S/c1-10-3-5-12(6-4-10)16(14,15)9-11(2)7-8-13/h3-6,9,13H,7-8H2,1-2H3/b11-9-
InChIKey JYAIWYGWQCHZQK-LUAWRHEFSA-N
Molecular Weight 240.317 g/mol
SMILES OCC\C(=C/S(c1ccc(cc1)C)(=O)=O)C
SPLASH splash10-001l-9020000000-374347c1a4d0cf383aa4
Source of Spectrum J-52-4264-26
Wiley ID 1242631