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3-(1-ethyl-3-methylpyrazol-5-yl)-5-(methylthio)-4-(alpha,alpha,alpha-trifluoro-m-tolyl)-4H-1,2,4-triazole

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3-(1-ethyl-3-methylpyrazol-5-yl)-5-(methylthio)-4-(alpha,alpha,alpha-trifluoro-m-tolyl)-4H-1,2,4-triazole
SpectraBase Compound ID LG0ial6ojEv
InChI InChI=1S/C16H16F3N5S/c1-4-23-13(8-10(2)22-23)14-20-21-15(25-3)24(14)12-7-5-6-11(9-12)16(17,18)19/h5-9H,4H2,1-3H3
InChIKey PNZORUAJLKZZFV-UHFFFAOYSA-N
Mol Weight 367.39 g/mol
Molecular Formula C16H16F3N5S
Exact Mass 367.107851 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID FkiK1wVHmAa
Name 3-(1-ETHYL-3-METHYLPYRAZOL-5-YL)-5-(METHYLTHIO)-4-(alpha,alpha,alpha-TRIFLUORO-m-TOLYL)-4H-1,2,4-TRIAZOLE
Source of Sample Maybridge Chemical Company Ltd., North Cornwall, England
Copyright Copyright © 1980, 1981-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C16H16F3N5S
InChI InChI=1S/C16H16F3N5S/c1-4-23-13(8-10(2)22-23)14-20-21-15(25-3)24(14)12-7-5-6-11(9-12)16(17,18)19/h5-9H,4H2,1-3H3
InChIKey PNZORUAJLKZZFV-UHFFFAOYSA-N
Melting Point 134-136C
Molecular Weight 367.40
Solvent Chloroform-d; Reference=TMS Spectrometer= Bruker AC-300
Synonyms TRIAZOLE, 4H-1,2,4-, 3-(1-ETHYL-3-METHYLPYRAZOL-5-YL)-5-(METHYLTHIO)-4-(alpha,alpha,alpha-TRIFLUORO-m-TOLYL)-,