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4,6-dichloro-m-toluenesulfonic acid, 2-methyl-5-oxo-1-cyclopenten-1-yl ester

View entire compound with spectra: 3 NMR, and 1 FTIR

4,6-dichloro-m-toluenesulfonic acid, 2-methyl-5-oxo-1-cyclopenten-1-yl ester
SpectraBase Compound ID 4P8xsbUqfCt
InChI InChI=1S/C13H12Cl2O4S/c1-7-3-4-11(16)13(7)19-20(17,18)12-5-8(2)9(14)6-10(12)15/h5-6H,3-4H2,1-2H3
InChIKey CWCRUAFTNRRLJA-UHFFFAOYSA-N
Mol Weight 335.2 g/mol
Molecular Formula C13H12Cl2O4S
Exact Mass 333.983335 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID vCUjSHQyKG
Name 4,6-DICHLORO-m-TOLUENESULFONIC ACID, 2-METHYL-5-OXO-1-CYCLOPENTEN-1-YL ESTER
Source of Sample Maybridge Chemical Company Ltd., North Cornwall, England
Copyright Copyright © 1980, 1981-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C13H12Cl2O4S
InChI InChI=1S/C13H12Cl2O4S/c1-7-3-4-11(16)13(7)19-20(17,18)12-5-8(2)9(14)6-10(12)15/h5-6H,3-4H2,1-2H3
InChIKey CWCRUAFTNRRLJA-UHFFFAOYSA-N
Melting Point 142-144C
Molecular Weight 335.21
Solvent Chloroform-d; Reference=TMS Spectrometer= Bruker AC-300