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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

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID 6w101wpMAnp
Name (E)-3-(4-Tolyl-sulfonyl)-acrylic acid, ethyl ester
CAS Registry Number 117659-25-3
Copyright Copyright © 2002-2024 Wiley-VCH Verlag GmbH & Co. KGaA. 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
Instrument Name Varian FT-80
Literature Reference C. Najera, B. Baldo, M.Yus, J. Chem. Soc. Perkin I 1029 (1988).
NMR Standard CDCl3
Origin Chemical Concepts. A Wiley Division. Weinheim, Germany
Solvent CDCl3