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4-{1-[(p-chlorophenyl)sulfonyl]pyrazol-5-yl}-5-methyl-3-isoxazolecarboxylic acid, methyl ester

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

4-{1-[(p-chlorophenyl)sulfonyl]pyrazol-5-yl}-5-methyl-3-isoxazolecarboxylic acid, methyl ester
SpectraBase Compound ID D4eFPj14a05
InChI InChI=1S/C15H12ClN3O5S/c1-9-13(14(18-24-9)15(20)23-2)12-7-8-17-19(12)25(21,22)11-5-3-10(16)4-6-11/h3-8H,1-2H3
InChIKey AABINEMNEMULSS-UHFFFAOYSA-N
Mol Weight 381.79 g/mol
Molecular Formula C15H12ClN3O5S
Exact Mass 381.018619 g/mol

1H Nuclear Magnetic Resonance (NMR) Spectrum

1H Nuclear Magnetic Resonance (NMR) Spectrum

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SpectraBase Spectrum ID Essk63fIKcD
Name 4-{1-[(p-CHLOROPHENYL)SULFONYL]PYRAZOL-5-YL}-5-METHYL-3-ISOXAZOLECARBOXYLIC ACID, METHYL ESTER
Source of Sample Maybridge Chemical Company Ltd., North Cornwall, England
Copyright Copyright © 1991-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C15H12ClN3O5S
InChI InChI=1S/C15H12ClN3O5S/c1-9-13(14(18-24-9)15(20)23-2)12-7-8-17-19(12)25(21,22)11-5-3-10(16)4-6-11/h3-8H,1-2H3
InChIKey AABINEMNEMULSS-UHFFFAOYSA-N
Instrument Name BRUKER AC-300
Molecular Weight 381.80
Solvent CDCl3; Reference=TMS; Temperature 297K