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2-{alpha-{[4-methyl-5-(trifluoromethyl)-4H-1,2,4-triazol-3-yl]thio}-p-tolyl}-1,3,4-oxadiazole

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2-{alpha-{[4-methyl-5-(trifluoromethyl)-4H-1,2,4-triazol-3-yl]thio}-p-tolyl}-1,3,4-oxadiazole
SpectraBase Compound ID 6putKGEMNHP
InChI InChI=1S/C13H10F3N5OS/c1-21-11(13(14,15)16)19-20-12(21)23-6-8-2-4-9(5-3-8)10-18-17-7-22-10/h2-5,7H,6H2,1H3
InChIKey YVAWLOYNPRPJPQ-UHFFFAOYSA-N
Mol Weight 341.31 g/mol
Molecular Formula C13H10F3N5OS
Exact Mass 341.055816 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID C1VgtVItdSC
Name 2-{alpha-{[4-METHYL-5-(TRIFLUOROMETHYL)-4H-1,2,4-TRIAZOL-3-YL]THIO}-p-TOLYL}-1,3,4-OXADIAZOLE
Source of Sample Maybridge Chemical Company Ltd., North Cornwall, England
Copyright Copyright © 1980, 1981-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C13H10F3N5OS
InChI InChI=1S/C13H10F3N5OS/c1-21-11(13(14,15)16)19-20-12(21)23-6-8-2-4-9(5-3-8)10-18-17-7-22-10/h2-5,7H,6H2,1H3
InChIKey YVAWLOYNPRPJPQ-UHFFFAOYSA-N
Melting Point 136-138C
Molecular Weight 341.32
Solvent Chloroform-d; Reference=TMS Spectrometer= Bruker AC-300
Synonyms OXADIAZOLE, 1,3,4-, 2-{alpha-{[4-METHYL-5-(TRIFLUOROMETHYL)-4H-1,2,4-TRIAZOL-3-YL]THIO}-p-TOLYL}-,