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acetic acid, [[5-(4-chlorophenyl)-4-(4-methylphenyl)-4H-1,2,4-triazol-3-yl]thio]-, 2-[(E)-[4-methoxy-3-(phenylmethoxy)phenyl]methylidene]hydrazide
SpectraBase Compound ID IQKqN9TSYoA
InChI InChI=1S/C32H28ClN5O3S/c1-22-8-15-27(16-9-22)38-31(25-11-13-26(33)14-12-25)36-37-32(38)42-21-30(39)35-34-19-24-10-17-28(40-2)29(18-24)41-20-23-6-4-3-5-7-23/h3-19H,20-21H2,1-2H3,(H,35,39)/b34-19+
InChIKey SUWFNNVAYTYTHL-ALQBTCKLSA-N
Mol Weight 598.1 g/mol
Molecular Formula C32H28ClN5O3S
Exact Mass 597.160139 g/mol

1H Nuclear Magnetic Resonance (NMR) Spectrum

1H Nuclear Magnetic Resonance (NMR) Spectrum

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SpectraBase Spectrum ID 28JSaAa8Pgs
Name acetic acid, [[5-(4-chlorophenyl)-4-(4-methylphenyl)-4H-1,2,4-triazol-3-yl]thio]-, 2-[(E)-[4-methoxy-3-(phenylmethoxy)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/C32H28ClN5O3S/c1-22-8-15-27(16-9-22)38-31(25-11-13-26(33)14-12-25)36-37-32(38)42-21-30(39)35-34-19-24-10-17-28(40-2)29(18-24)41-20-23-6-4-3-5-7-23/h3-19H,20-21H2,1-2H3,(H,35,39)/b34-19+
InChIKey SUWFNNVAYTYTHL-ALQBTCKLSA-N
NMR Offset 18.0068
NMR Spectrometer Frequency 500.134
Observed nucleus 1H
Origin 1H_CB_8313_5253
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/10249219