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

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acetic acid, [[4-(4-methylphenyl)-5-phenyl-4H-1,2,4-triazol-3-yl]thio]-, 2-[(E)-[4-(1-methylethyl)phenyl]methylidene]hydrazide
SpectraBase Compound ID JtDROjL9Une
InChI InChI=1S/C27H27N5OS/c1-19(2)22-13-11-21(12-14-22)17-28-29-25(33)18-34-27-31-30-26(23-7-5-4-6-8-23)32(27)24-15-9-20(3)10-16-24/h4-17,19H,18H2,1-3H3,(H,29,33)/b28-17+
InChIKey YQDYDUQDTUUOKW-OGLMXYFKSA-N
Mol Weight 469.61 g/mol
Molecular Formula C27H27N5OS
Exact Mass 469.193632 g/mol

1H Nuclear Magnetic Resonance (NMR) Spectrum

1H Nuclear Magnetic Resonance (NMR) Spectrum

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SpectraBase Spectrum ID 9H2kh1UsqEZ
Name acetic acid, [[4-(4-methylphenyl)-5-phenyl-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/C27H27N5OS/c1-19(2)22-13-11-21(12-14-22)17-28-29-25(33)18-34-27-31-30-26(23-7-5-4-6-8-23)32(27)24-15-9-20(3)10-16-24/h4-17,19H,18H2,1-3H3,(H,29,33)/b28-17+
InChIKey YQDYDUQDTUUOKW-OGLMXYFKSA-N
NMR Offset 18.0068
NMR Spectrometer Frequency 500.134
Observed nucleus 1H
Origin 1H_CB_8313_4780
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/10248119