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acetic acid, [[5-(4-methylphenyl)-4-phenyl-4H-1,2,4-triazol-3-yl]thio]-, 2-[(E)-[4-(trifluoromethyl)phenyl]methylidene]hydrazide

View entire compound with spectra: 1 NMR

acetic acid, [[5-(4-methylphenyl)-4-phenyl-4H-1,2,4-triazol-3-yl]thio]-, 2-[(E)-[4-(trifluoromethyl)phenyl]methylidene]hydrazide
SpectraBase Compound ID KW9GYJSObap
InChI InChI=1S/C25H20F3N5OS/c1-17-7-11-19(12-8-17)23-31-32-24(33(23)21-5-3-2-4-6-21)35-16-22(34)30-29-15-18-9-13-20(14-10-18)25(26,27)28/h2-15H,16H2,1H3,(H,30,34)/b29-15+
InChIKey GXAVNFQXSFWKCO-WKULSOCRSA-N
Mol Weight 495.52 g/mol
Molecular Formula C25H20F3N5OS
Exact Mass 495.134066 g/mol

1H Nuclear Magnetic Resonance (NMR) Spectrum

1H Nuclear Magnetic Resonance (NMR) Spectrum

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SpectraBase Spectrum ID FDCOKBCod3N
Name acetic acid, [[5-(4-methylphenyl)-4-phenyl-4H-1,2,4-triazol-3-yl]thio]-, 2-[(E)-[4-(trifluoromethyl)phenyl]methylidene]hydrazide
Author A.V.Yarkov, IPAC, Russia
Copyright Copyright © 2016-2024 Chemical Block, Russia, Leninsky Prospect 47 - Database Compilation Copyright © 2016-2021 John Wiley & Sons, Inc. All Rights Reserved.
InChI InChI=1S/C25H20F3N5OS/c1-17-7-11-19(12-8-17)23-31-32-24(33(23)21-5-3-2-4-6-21)35-16-22(34)30-29-15-18-9-13-20(14-10-18)25(26,27)28/h2-15H,16H2,1H3,(H,30,34)/b29-15+
InChIKey GXAVNFQXSFWKCO-WKULSOCRSA-N
NMR Offset 18.0068
NMR Spectrometer Frequency 500.134
Observed nucleus 1H
Origin 1H_CB_8313_5230
Owner Copyright (C) 2016 Chemical Block, Russia, Leninsky Prospect 47 - Database Compilation Copyright (C) 2016 John Wiley & Sons, Inc.
Sample State soluted
Solvent DMSO-d6
Source File Reference VendorID: NMR/10249094