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

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acetic acid, [[5-(4-chlorophenyl)-4-(4-methylphenyl)-4H-1,2,4-triazol-3-yl]thio]-, 2-[(E)-[4-(1,1-dimethylethyl)phenyl]methylidene]hydrazide
SpectraBase Compound ID 4h6eurrQ4nm
InChI InChI=1S/C28H28ClN5OS/c1-19-5-15-24(16-6-19)34-26(21-9-13-23(29)14-10-21)32-33-27(34)36-18-25(35)31-30-17-20-7-11-22(12-8-20)28(2,3)4/h5-17H,18H2,1-4H3,(H,31,35)/b30-17+
InChIKey RCIDPBSDUUOVIH-OCSSWDANSA-N
Mol Weight 518.08 g/mol
Molecular Formula C28H28ClN5OS
Exact Mass 517.170309 g/mol

1H Nuclear Magnetic Resonance (NMR) Spectrum

1H Nuclear Magnetic Resonance (NMR) Spectrum

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SpectraBase Spectrum ID 1jwglqw3Vi6
Name acetic acid, [[5-(4-chlorophenyl)-4-(4-methylphenyl)-4H-1,2,4-triazol-3-yl]thio]-, 2-[(E)-[4-(1,1-dimethylethyl)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/C28H28ClN5OS/c1-19-5-15-24(16-6-19)34-26(21-9-13-23(29)14-10-21)32-33-27(34)36-18-25(35)31-30-17-20-7-11-22(12-8-20)28(2,3)4/h5-17H,18H2,1-4H3,(H,31,35)/b30-17+
InChIKey RCIDPBSDUUOVIH-OCSSWDANSA-N
NMR Offset 18.0068
NMR Spectrometer Frequency 500.134
Observed nucleus 1H
Origin 1H_CB_8313_5249
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/10249212