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acetic acid, [[5-(4-chlorophenyl)-4-(4-methylphenyl)-4H-1,2,4-triazol-3-yl]thio]-, 2-[(E)-[4-(1-methylethyl)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)-[4-(1-methylethyl)phenyl]methylidene]hydrazide
SpectraBase Compound ID 8SuWJgIbC8q
InChI InChI=1S/C27H26ClN5OS/c1-18(2)21-8-6-20(7-9-21)16-29-30-25(34)17-35-27-32-31-26(22-10-12-23(28)13-11-22)33(27)24-14-4-19(3)5-15-24/h4-16,18H,17H2,1-3H3,(H,30,34)/b29-16+
InChIKey RIFHFAWQQDWPDX-MUFRIFMGSA-N
Mol Weight 504.05 g/mol
Molecular Formula C27H26ClN5OS
Exact Mass 503.154659 g/mol

1H Nuclear Magnetic Resonance (NMR) Spectrum

1H Nuclear Magnetic Resonance (NMR) Spectrum

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SpectraBase Spectrum ID IHHQhmu5YoL
Name acetic acid, [[5-(4-chlorophenyl)-4-(4-methylphenyl)-4H-1,2,4-triazol-3-yl]thio]-, 2-[(E)-[4-(1-methylethyl)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/C27H26ClN5OS/c1-18(2)21-8-6-20(7-9-21)16-29-30-25(34)17-35-27-32-31-26(22-10-12-23(28)13-11-22)33(27)24-14-4-19(3)5-15-24/h4-16,18H,17H2,1-3H3,(H,30,34)/b29-16+
InChIKey RIFHFAWQQDWPDX-MUFRIFMGSA-N
NMR Offset 18.0068
NMR Spectrometer Frequency 500.134
Observed nucleus 1H
Origin 1H_CB_8313_5280
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/10249248