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

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acetic acid, [[5-(3,4-dimethoxyphenyl)-4-phenyl-4H-1,2,4-triazol-3-yl]thio]-, 2-[(E)-(3-ethoxy-4-hydroxyphenyl)methylidene]hydrazide
SpectraBase Compound ID BfypocD9Avg
InChI InChI=1S/C27H27N5O5S/c1-4-37-23-14-18(10-12-21(23)33)16-28-29-25(34)17-38-27-31-30-26(32(27)20-8-6-5-7-9-20)19-11-13-22(35-2)24(15-19)36-3/h5-16,33H,4,17H2,1-3H3,(H,29,34)/b28-16+
InChIKey WBJIMRKTDURHIV-LQKURTRISA-N
Mol Weight 533.6 g/mol
Molecular Formula C27H27N5O5S
Exact Mass 533.17329 g/mol

1H Nuclear Magnetic Resonance (NMR) Spectrum

1H Nuclear Magnetic Resonance (NMR) Spectrum

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SpectraBase Spectrum ID Iw8wn3nmOyT
Name acetic acid, [[5-(3,4-dimethoxyphenyl)-4-phenyl-4H-1,2,4-triazol-3-yl]thio]-, 2-[(E)-(3-ethoxy-4-hydroxyphenyl)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/C27H27N5O5S/c1-4-37-23-14-18(10-12-21(23)33)16-28-29-25(34)17-38-27-31-30-26(32(27)20-8-6-5-7-9-20)19-11-13-22(35-2)24(15-19)36-3/h5-16,33H,4,17H2,1-3H3,(H,29,34)/b28-16+
InChIKey WBJIMRKTDURHIV-LQKURTRISA-N
NMR Offset 17.0068
NMR Spectrometer Frequency 500.134
Observed nucleus 1H
Origin 1H_CB_8313_3983
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/10239388