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acetic acid, [[5-(4-chlorophenyl)-4-(4-methylphenyl)-4H-1,2,4-triazol-3-yl]thio]-, 2-[(E)-1-(3,4-dichlorophenyl)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-(3,4-dichlorophenyl)ethylidene]hydrazide
SpectraBase Compound ID 30dab9MHntJ
InChI InChI=1S/C25H20Cl3N5OS/c1-15-3-10-20(11-4-15)33-24(17-5-8-19(26)9-6-17)31-32-25(33)35-14-23(34)30-29-16(2)18-7-12-21(27)22(28)13-18/h3-13H,14H2,1-2H3,(H,30,34)/b29-16+
InChIKey WFPFJPKIDKCDDC-MUFRIFMGSA-N
Mol Weight 544.89 g/mol
Molecular Formula C25H20Cl3N5OS
Exact Mass 543.045415 g/mol

1H Nuclear Magnetic Resonance (NMR) Spectrum

1H Nuclear Magnetic Resonance (NMR) Spectrum

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SpectraBase Spectrum ID 2JPoJUNgtec
Name acetic acid, [[5-(4-chlorophenyl)-4-(4-methylphenyl)-4H-1,2,4-triazol-3-yl]thio]-, 2-[(E)-1-(3,4-dichlorophenyl)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/C25H20Cl3N5OS/c1-15-3-10-20(11-4-15)33-24(17-5-8-19(26)9-6-17)31-32-25(33)35-14-23(34)30-29-16(2)18-7-12-21(27)22(28)13-18/h3-13H,14H2,1-2H3,(H,30,34)/b29-16+
InChIKey WFPFJPKIDKCDDC-MUFRIFMGSA-N
NMR Offset 18.0068
NMR Spectrometer Frequency 500.134
Observed nucleus 1H
Origin 1H_CB_8313_5300
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/10249272