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3-{[(p-chlorophenyl)thio]methyl}-5-(3,5-dimethyl-4-isoxazolyl)-1,2,4-oxadiazole

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

3-{[(p-chlorophenyl)thio]methyl}-5-(3,5-dimethyl-4-isoxazolyl)-1,2,4-oxadiazole
SpectraBase Compound ID 9ZiIm3fSuig
InChI InChI=1S/C14H12ClN3O2S/c1-8-13(9(2)19-17-8)14-16-12(18-20-14)7-21-11-5-3-10(15)4-6-11/h3-6H,7H2,1-2H3
InChIKey QVYMHIWFLMOMDP-UHFFFAOYSA-N
Mol Weight 321.78 g/mol
Molecular Formula C14H12ClN3O2S
Exact Mass 321.033876 g/mol

1H Nuclear Magnetic Resonance (NMR) Spectrum

1H Nuclear Magnetic Resonance (NMR) Spectrum

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SpectraBase Spectrum ID fvI7NunJZ3
Name 3-{[(p-CHLOROPHENYL)THIO]METHYL}-5-(3,5-DIMETHYL-4-ISOXAZOLYL)-1,2,4-OXADIAZOLE
Source of Sample Maybridge Chemical Company Ltd., North Cornwall, England
Copyright Copyright © 1991-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C14H12ClN3O2S
InChI InChI=1S/C14H12ClN3O2S/c1-8-13(9(2)19-17-8)14-16-12(18-20-14)7-21-11-5-3-10(15)4-6-11/h3-6H,7H2,1-2H3
InChIKey QVYMHIWFLMOMDP-UHFFFAOYSA-N
Instrument Name BRUKER AC-300
Melting Point 101-102C
Molecular Weight 321.79
Solvent CDCl3; Reference=TMS; Temperature 297K