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(E)-3-(4-Tolyl-sulfonyl)-acrylic acid, ethyl ester
SpectraBase Compound ID CbyCC4rzh3A
InChI InChI=1S/C12H14O4S/c1-3-16-12(13)8-9-17(14,15)11-6-4-10(2)5-7-11/h4-9H,3H2,1-2H3/b9-8+
InChIKey IVQHTVXRSHDTBE-CMDGGOBGSA-N
Mol Weight 254.3 g/mol
Molecular Formula C12H14O4S
Exact Mass 254.06128 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 1wp9qSpjQIS
Name (E)-3-(4-methylphenyl)sulfonyl-2-propenoic acid ethyl ester
Alternate Name(s) (E)-3-tosylacrylic acid ethyl ester Ethyl (E)-3-(4-methylphenyl)sulfonylprop-2-enoate Ethyl (E)-3-(p-tolylsulfonyl)prop-2-enoate
CAS Registry Number 117659-25-3
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C12H14O4S
InChI InChI=1S/C12H14O4S/c1-3-16-12(13)8-9-17(14,15)11-6-4-10(2)5-7-11/h4-9H,3H2,1-2H3/b9-8+
InChIKey IVQHTVXRSHDTBE-CMDGGOBGSA-N
Molecular Weight 254.300 g/mol
SMILES C(\C=C\S(c1ccc(cc1)C)(=O)=O)(=O)OCC
SPLASH splash10-000i-6910000000-e61d89f7bac2f484a32a
Source of Spectrum KC-1988-1031-3
Wiley ID 1257354