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5-(allylthio)-3-(2,4-dimethyl-5-thiazolyl)-4-(alpha,alpha,alpha-trifluoro-o-tolyl)-4H-1,2,4-triazole

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5-(allylthio)-3-(2,4-dimethyl-5-thiazolyl)-4-(alpha,alpha,alpha-trifluoro-o-tolyl)-4H-1,2,4-triazole
SpectraBase Compound ID ARTieyxYbaX
InChI InChI=1S/C17H15F3N4S2/c1-4-9-25-16-23-22-15(14-10(2)21-11(3)26-14)24(16)13-8-6-5-7-12(13)17(18,19)20/h4-8H,1,9H2,2-3H3
InChIKey ADCRGSDPBBFDAO-UHFFFAOYSA-N
Mol Weight 396.45 g/mol
Molecular Formula C17H15F3N4S2
Exact Mass 396.069023 g/mol

1H Nuclear Magnetic Resonance (NMR) Spectrum

1H Nuclear Magnetic Resonance (NMR) Spectrum

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SpectraBase Spectrum ID FzP599M7EKA
Name 5-(ALLYLTHIO)-3-(2,4-DIMETHYL-5-THIAZOLYL)-4-(alpha,alpha,alpha-TRIFLUORO-o-TOLYL)-4H-1,2,4-TRIAZOLE
Source of Sample Maybridge Chemical Company Ltd., North Cornwall, England
Copyright Copyright © 1991-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C17H15F3N4S2
InChI InChI=1S/C17H15F3N4S2/c1-4-9-25-16-23-22-15(14-10(2)21-11(3)26-14)24(16)13-8-6-5-7-12(13)17(18,19)20/h4-8H,1,9H2,2-3H3
InChIKey ADCRGSDPBBFDAO-UHFFFAOYSA-N
Instrument Name BRUKER AC-300
Melting Point 98-100C
Molecular Weight 396.46
Solvent CDCl3; Reference=TMS; Temperature 297K