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

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acetic acid, [[5-(4-chlorophenyl)-4-(4-methylphenyl)-4H-1,2,4-triazol-3-yl]thio]-, 2-[(E)-1-(4-fluorophenyl)ethylidene]hydrazide
SpectraBase Compound ID 4hCbs1BWH5l
InChI InChI=1S/C25H21ClFN5OS/c1-16-3-13-22(14-4-16)32-24(19-5-9-20(26)10-6-19)30-31-25(32)34-15-23(33)29-28-17(2)18-7-11-21(27)12-8-18/h3-14H,15H2,1-2H3,(H,29,33)/b28-17+
InChIKey XJZJGOBZEHFAEK-OGLMXYFKSA-N
Mol Weight 493.99 g/mol
Molecular Formula C25H21ClFN5OS
Exact Mass 493.113937 g/mol

1H Nuclear Magnetic Resonance (NMR) Spectrum

1H Nuclear Magnetic Resonance (NMR) Spectrum

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SpectraBase Spectrum ID 4pJkrzgd1GE
Name acetic acid, [[5-(4-chlorophenyl)-4-(4-methylphenyl)-4H-1,2,4-triazol-3-yl]thio]-, 2-[(E)-1-(4-fluorophenyl)ethylidene]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/C25H21ClFN5OS/c1-16-3-13-22(14-4-16)32-24(19-5-9-20(26)10-6-19)30-31-25(32)34-15-23(33)29-28-17(2)18-7-11-21(27)12-8-18/h3-14H,15H2,1-2H3,(H,29,33)/b28-17+
InChIKey XJZJGOBZEHFAEK-OGLMXYFKSA-N
NMR Offset 18.0068
NMR Spectrometer Frequency 500.134
Observed nucleus 1H
Origin 1H_CB_8313_5304
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/10249276