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

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acetic acid, [[5-(4-methoxyphenyl)-4-phenyl-4H-1,2,4-triazol-3-yl]thio]-, 2-[(E)-[2-(trifluoromethyl)phenyl]methylidene]hydrazide
SpectraBase Compound ID LW98trRlHR5
InChI InChI=1S/C25H20F3N5O2S/c1-35-20-13-11-17(12-14-20)23-31-32-24(33(23)19-8-3-2-4-9-19)36-16-22(34)30-29-15-18-7-5-6-10-21(18)25(26,27)28/h2-15H,16H2,1H3,(H,30,34)/b29-15+
InChIKey SLYYMKOWZGRACD-WKULSOCRSA-N
Mol Weight 511.52 g/mol
Molecular Formula C25H20F3N5O2S
Exact Mass 511.128981 g/mol

1H Nuclear Magnetic Resonance (NMR) Spectrum

1H Nuclear Magnetic Resonance (NMR) Spectrum

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SpectraBase Spectrum ID GVScUQUx95b
Name acetic acid, [[5-(4-methoxyphenyl)-4-phenyl-4H-1,2,4-triazol-3-yl]thio]-, 2-[(E)-[2-(trifluoromethyl)phenyl]methylidene]hydrazide
Author A.V.Yarkov, IPAC, Russia
Copyright Copyright © 2016-2025 Chemical Block, Russia, Leninsky Prospect 47 - Database Compilation Copyright © 2016-2025 John Wiley & Sons, Inc. All Rights Reserved.
InChI InChI=1S/C25H20F3N5O2S/c1-35-20-13-11-17(12-14-20)23-31-32-24(33(23)19-8-3-2-4-9-19)36-16-22(34)30-29-15-18-7-5-6-10-21(18)25(26,27)28/h2-15H,16H2,1H3,(H,30,34)/b29-15+
InChIKey SLYYMKOWZGRACD-WKULSOCRSA-N
NMR Offset 18.0068
NMR Spectrometer Frequency 500.134
Observed nucleus 1H
Origin 1H_CB_8313_4505
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/10247420