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

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acetic acid, [[5-(4-chlorophenyl)-4-(4-methylphenyl)-4H-1,2,4-triazol-3-yl]thio]-, 2-[(E)-[2-(trifluoromethyl)phenyl]methylidene]hydrazide
SpectraBase Compound ID 5zdWjsqdkWe
InChI InChI=1S/C25H19ClF3N5OS/c1-16-6-12-20(13-7-16)34-23(17-8-10-19(26)11-9-17)32-33-24(34)36-15-22(35)31-30-14-18-4-2-3-5-21(18)25(27,28)29/h2-14H,15H2,1H3,(H,31,35)/b30-14+
InChIKey GDFOWLIEQXBXPN-AMVVHIIESA-N
Mol Weight 529.97 g/mol
Molecular Formula C25H19ClF3N5OS
Exact Mass 529.095094 g/mol

1H Nuclear Magnetic Resonance (NMR) Spectrum

1H Nuclear Magnetic Resonance (NMR) Spectrum

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SpectraBase Spectrum ID BkyC9Gx1NLC
Name acetic acid, [[5-(4-chlorophenyl)-4-(4-methylphenyl)-4H-1,2,4-triazol-3-yl]thio]-, 2-[(E)-[2-(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/C25H19ClF3N5OS/c1-16-6-12-20(13-7-16)34-23(17-8-10-19(26)11-9-17)32-33-24(34)36-15-22(35)31-30-14-18-4-2-3-5-21(18)25(27,28)29/h2-14H,15H2,1H3,(H,31,35)/b30-14+
InChIKey GDFOWLIEQXBXPN-AMVVHIIESA-N
NMR Offset 18.0068
NMR Spectrometer Frequency 500.134
Observed nucleus 1H
Origin 1H_CB_8313_5251
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/10249214