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

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acetic acid, [[5-(4-methylphenyl)-4-phenyl-4H-1,2,4-triazol-3-yl]thio]-, 2-[(E)-(4-ethoxy-3-methoxyphenyl)methylidene]hydrazide
SpectraBase Compound ID K0JC9FJMFMZ
InChI InChI=1S/C27H27N5O3S/c1-4-35-23-15-12-20(16-24(23)34-3)17-28-29-25(33)18-36-27-31-30-26(21-13-10-19(2)11-14-21)32(27)22-8-6-5-7-9-22/h5-17H,4,18H2,1-3H3,(H,29,33)/b28-17+
InChIKey LFGDCUABZPXIKP-OGLMXYFKSA-N
Mol Weight 501.61 g/mol
Molecular Formula C27H27N5O3S
Exact Mass 501.183461 g/mol

1H Nuclear Magnetic Resonance (NMR) Spectrum

1H Nuclear Magnetic Resonance (NMR) Spectrum

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SpectraBase Spectrum ID 2twvnOT7S6j
Name acetic acid, [[5-(4-methylphenyl)-4-phenyl-4H-1,2,4-triazol-3-yl]thio]-, 2-[(E)-(4-ethoxy-3-methoxyphenyl)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/C27H27N5O3S/c1-4-35-23-15-12-20(16-24(23)34-3)17-28-29-25(33)18-36-27-31-30-26(21-13-10-19(2)11-14-21)32(27)22-8-6-5-7-9-22/h5-17H,4,18H2,1-3H3,(H,29,33)/b28-17+
InChIKey LFGDCUABZPXIKP-OGLMXYFKSA-N
NMR Offset 18.0068
NMR Spectrometer Frequency 500.134
Observed nucleus 1H
Origin 1H_CB_8313_5220
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/10249084