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3-{[(p-chlorophenyl)sulfonyl]methyl}-5-(3,5-dimethyl-4-isoxazolyl)-1,2,4-oxadiazole
SpectraBase Compound ID GP091jc7U8D
InChI InChI=1S/C14H12ClN3O4S/c1-8-13(9(2)21-17-8)14-16-12(18-22-14)7-23(19,20)11-5-3-10(15)4-6-11/h3-6H,7H2,1-2H3
InChIKey BBWSWFNXCDZMQE-UHFFFAOYSA-N
Mol Weight 353.78 g/mol
Molecular Formula C14H12ClN3O4S
Exact Mass 353.023705 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID 5n4FZFBZsPQ
Name 3-{[(p-CHLOROPHENYL)SULFONYL]METHYL}-5-(3,5-DIMETHYL-4-ISOXAZOLYL)-1,2,4-OXADIAZOLE
Source of Sample Maybridge Chemical Company Ltd., North Cornwall, England
Copyright Copyright © 1980, 1981-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C14H12ClN3O4S
InChI InChI=1S/C14H12ClN3O4S/c1-8-13(9(2)21-17-8)14-16-12(18-22-14)7-23(19,20)11-5-3-10(15)4-6-11/h3-6H,7H2,1-2H3
InChIKey BBWSWFNXCDZMQE-UHFFFAOYSA-N
Molecular Weight 353.79
Solvent Chloroform-d; Reference=TMS Spectrometer= Bruker AC-300
Synonyms OXADIAZOLE, 1,2,4-, 3-{[(p-CHLOROPHENYL)SULFONYL]METHYL}-5-(3,5-DIMETHYL-4-ISOXAZOLYL)-,