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(E)-3-methyl-4-(4-methylphenyl)sulfonyl-2-butenoic acid methyl ester
SpectraBase Compound ID 1yOi89fX2Yi
InChI InChI=1S/C13H16O4S/c1-10-4-6-12(7-5-10)18(15,16)9-11(2)8-13(14)17-3/h4-8H,9H2,1-3H3/b11-8+
InChIKey UHVOXNUYHRUQDY-DHZHZOJOSA-N
Mol Weight 268.33 g/mol
Molecular Formula C13H16O4S
Exact Mass 268.07693 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 3FxM9yvTKeR
Name (E)-3-methyl-4-(4-methylphenyl)sulfonyl-2-butenoic acid methyl ester
CAS Registry Number 103793-13-1
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C13H16O4S
InChI InChI=1S/C13H16O4S/c1-10-4-6-12(7-5-10)18(15,16)9-11(2)8-13(14)17-3/h4-8H,9H2,1-3H3/b11-8+
InChIKey UHVOXNUYHRUQDY-DHZHZOJOSA-N
Molecular Weight 268.327 g/mol
SMILES C(S(c1ccc(cc1)C)(=O)=O)\C(=C\C(=O)OC)C
SPLASH splash10-01q9-7910000000-749fe9fdee03617ba4e5
Source of Spectrum H-68-1536-53
Synonyms (E)-3-methyl-4-tosyl-but-2-enoic acid methyl ester Methyl (E)-3-methyl-4-(4-methylphenyl)sulfonyl-but-2-enoate Methyl (E)-3-methyl-4-(p-tolylsulfonyl)but-2-enoate
Wiley ID 1271822