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4-[(p-chlorophenyl)sulfonyl]-3-methyl-2-thiophenecarboxylic acid, methyl ester

View entire compound with spectra: 2 NMR, and 1 FTIR

4-[(p-chlorophenyl)sulfonyl]-3-methyl-2-thiophenecarboxylic acid, methyl ester
SpectraBase Compound ID 4ZLcOwnExDQ
InChI InChI=1S/C13H11ClO4S2/c1-8-11(7-19-12(8)13(15)18-2)20(16,17)10-5-3-9(14)4-6-10/h3-7H,1-2H3
InChIKey QYCQNXGCCPPUIT-UHFFFAOYSA-N
Mol Weight 330.8 g/mol
Molecular Formula C13H11ClO4S2
Exact Mass 329.978729 g/mol

1H Nuclear Magnetic Resonance (NMR) Spectrum

1H Nuclear Magnetic Resonance (NMR) Spectrum

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SpectraBase Spectrum ID gFgtJlgtwV
Name 4-[(p-CHLOROPHENYL)SULFONYL]-3-METHYL-2-THIOPHENECARBOXYLIC ACID, METHYL ESTER
Source of Sample Maybridge Chemical Company Ltd., North Cornwall, England
Copyright Copyright © 1991-2025 John Wiley & Sons, Inc. All Rights Reserved.
Formula C13H11ClO4S2
InChI InChI=1S/C13H11ClO4S2/c1-8-11(7-19-12(8)13(15)18-2)20(16,17)10-5-3-9(14)4-6-10/h3-7H,1-2H3
InChIKey QYCQNXGCCPPUIT-UHFFFAOYSA-N
Instrument Name BRUKER AC-300
Melting Point 145-147.5C
Molecular Weight 330.81
Solvent CDCl3; Reference=TMS; Temperature 297K