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acetic acid, [[5-(4-chlorophenyl)-4-(4-methylphenyl)-4H-1,2,4-triazol-3-yl]thio]-, 2-[(E)-[3,5-bis(1,1-dimethylethyl)-4-hydroxyphenyl]methylidene]hydrazide

View entire compound with spectra: 1 NMR

acetic acid, [[5-(4-chlorophenyl)-4-(4-methylphenyl)-4H-1,2,4-triazol-3-yl]thio]-, 2-[(E)-[3,5-bis(1,1-dimethylethyl)-4-hydroxyphenyl]methylidene]hydrazide
SpectraBase Compound ID 98PXeLOYwmL
InChI InChI=1S/C32H36ClN5O2S/c1-20-8-14-24(15-9-20)38-29(22-10-12-23(33)13-11-22)36-37-30(38)41-19-27(39)35-34-18-21-16-25(31(2,3)4)28(40)26(17-21)32(5,6)7/h8-18,40H,19H2,1-7H3,(H,35,39)/b34-18+
InChIKey KJPKWZFZECMEBA-FABQOPTDSA-N
Mol Weight 590.2 g/mol
Molecular Formula C32H36ClN5O2S
Exact Mass 589.227824 g/mol

1H Nuclear Magnetic Resonance (NMR) Spectrum

1H Nuclear Magnetic Resonance (NMR) Spectrum

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SpectraBase Spectrum ID ETzGHkXSi4U
Name acetic acid, [[5-(4-chlorophenyl)-4-(4-methylphenyl)-4H-1,2,4-triazol-3-yl]thio]-, 2-[(E)-[3,5-bis(1,1-dimethylethyl)-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/C32H36ClN5O2S/c1-20-8-14-24(15-9-20)38-29(22-10-12-23(33)13-11-22)36-37-30(38)41-19-27(39)35-34-18-21-16-25(31(2,3)4)28(40)26(17-21)32(5,6)7/h8-18,40H,19H2,1-7H3,(H,35,39)/b34-18+
InChIKey KJPKWZFZECMEBA-FABQOPTDSA-N
NMR Offset 18.0068
NMR Spectrometer Frequency 500.134
Observed nucleus 1H
Origin 1H_CB_8313_5284
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/10249252