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4-METHYL-BENZOYL-ETHENE-SULFONYL-ACETIC-ACID-METHYLESTER
SpectraBase Compound ID KNncXCxUYx3
InChI InChI=1S/C13H14O5S/c1-10-3-5-11(6-4-10)12(14)7-8-19(16,17)9-13(15)18-2/h3-8H,9H2,1-2H3/b8-7+
InChIKey GMGMXDRLTMRZFZ-BQYQJAHWSA-N
Mol Weight 282.31 g/mol
Molecular Formula C13H14O5S
Exact Mass 282.056195 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID HaQAskFeVZR
Name 4-METHYL-BENZOYL-ETHENE-SULFONYL-ACETIC-ACID-METHYLESTER
Compound Number 4B
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C13H14O5S
InChI InChI=1S/C13H14O5S/c1-10-3-5-11(6-4-10)12(14)7-8-19(16,17)9-13(15)18-2/h3-8H,9H2,1-2H3/b8-7+
InChIKey GMGMXDRLTMRZFZ-BQYQJAHWSA-N
Literature Reference Author V.PADMAVATHI,A.V.N.MOHAN,K.MAHESH,A.PADMAJA
Literature Reference Citation CHEM.PHARM.BULL.,56,815(2008)
Literature Reference DOI 10.1248/cpb.56.815
Molecular Weight 282.311 g/mol
Sample ID 1773
Solvent CDCl3