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3,5-dimethyl-4-isoxazolesulfonic acid, o-chlorophenyl ester

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

3,5-dimethyl-4-isoxazolesulfonic acid, o-chlorophenyl ester
SpectraBase Compound ID KvF2HtQSJ5L
InChI InChI=1S/C11H10ClNO4S/c1-7-11(8(2)16-13-7)18(14,15)17-10-6-4-3-5-9(10)12/h3-6H,1-2H3
InChIKey DCGKPQASGFYADE-UHFFFAOYSA-N
Mol Weight 287.72 g/mol
Molecular Formula C11H10ClNO4S
Exact Mass 287.001907 g/mol

1H Nuclear Magnetic Resonance (NMR) Spectrum

1H Nuclear Magnetic Resonance (NMR) Spectrum

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SpectraBase Spectrum ID L1HhuBgE8OG
Name 3,5-DIMETHYL-4-ISOXAZOLESULFONIC ACID, o-CHLOROPHENYL ESTER
Source of Sample Maybridge Chemical Company Ltd., North Cornwall, England
Copyright Copyright © 1991-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C11H10ClNO4S
InChI InChI=1S/C11H10ClNO4S/c1-7-11(8(2)16-13-7)18(14,15)17-10-6-4-3-5-9(10)12/h3-6H,1-2H3
InChIKey DCGKPQASGFYADE-UHFFFAOYSA-N
Instrument Name BRUKER AC-300
Melting Point 52-54C
Molecular Weight 287.72
Solvent CDCl3; Reference=TMS; Temperature 297K