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2-{[5-(4-chlorophenyl)-4-ethyl-4H-1,2,4-triazol-3-yl]sulfanyl}-N'-[(2E)-1-methyl-3-phenyl-2-propenylidene]acetohydrazide
SpectraBase Compound ID F3yMA9BEhmo
InChI InChI=1S/C22H22ClN5OS/c1-3-28-21(18-11-13-19(23)14-12-18)26-27-22(28)30-15-20(29)25-24-16(2)9-10-17-7-5-4-6-8-17/h4-14H,3,15H2,1-2H3,(H,25,29)/b10-9+,24-16?
InChIKey CFFMAYJJRRCNMH-ABBUQKJFSA-N
Mol Weight 439.97 g/mol
Molecular Formula C22H22ClN5OS
Exact Mass 439.123359 g/mol

1H Nuclear Magnetic Resonance (NMR) Spectrum

1H Nuclear Magnetic Resonance (NMR) Spectrum

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SpectraBase Spectrum ID 2mBfm3rMCWB
Name 2-{[5-(4-chlorophenyl)-4-ethyl-4H-1,2,4-triazol-3-yl]sulfanyl}-N'-[(2E)-1-methyl-3-phenyl-2-propenylidene]acetohydrazide
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/C22H22ClN5OS/c1-3-28-21(18-11-13-19(23)14-12-18)26-27-22(28)30-15-20(29)25-24-16(2)9-10-17-7-5-4-6-8-17/h4-14H,3,15H2,1-2H3,(H,25,29)/b10-9+,24-16?
InChIKey CFFMAYJJRRCNMH-ABBUQKJFSA-N
NMR Offset 15.328
NMR Spectrometer Frequency 300.135
Observed nucleus 1H
Origin 1H_UBI_21270_20395
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: UZI/9163884; UBI_ID: UBI-020399
Synonyms 2-{[5-(4-chlorophenyl)-4-ethyl-4H-1,2,4-triazol-3-yl]sulfanyl}-N'-[1-methyl-3-phenyl-2-propenylidene]acetohydrazide
Temperature 318 °C