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4-{[(E)-(3,4-dimethoxyphenyl)methylidene]amino}-5-(3-methylphenyl)-4H-1,2,4-triazole-3-thiol
SpectraBase Compound ID 1sGSeJX5D8B
InChI InChI=1S/C18H18N4O2S/c1-12-5-4-6-14(9-12)17-20-21-18(25)22(17)19-11-13-7-8-15(23-2)16(10-13)24-3/h4-11H,1-3H3,(H,21,25)/b19-11+
InChIKey AEJIRBXANWFFMU-YBFXNURJSA-N
Mol Weight 354.43 g/mol
Molecular Formula C18H18N4O2S
Exact Mass 354.115047 g/mol

1H Nuclear Magnetic Resonance (NMR) Spectrum

1H Nuclear Magnetic Resonance (NMR) Spectrum

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SpectraBase Spectrum ID FcrnsRE8ngP
Name 4-{[(E)-(3,4-dimethoxyphenyl)methylidene]amino}-5-(3-methylphenyl)-4H-1,2,4-triazole-3-thiol
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/C18H18N4O2S/c1-12-5-4-6-14(9-12)17-20-21-18(25)22(17)19-11-13-7-8-15(23-2)16(10-13)24-3/h4-11H,1-3H3,(H,21,25)/b19-11+
InChIKey AEJIRBXANWFFMU-YBFXNURJSA-N
NMR Offset 15.5012
NMR Spectrometer Frequency 300.135
Observed nucleus 1H
Origin 1H_SBI_36227_16854
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: D25099; Labnumber: GRES-03129; SBI_ID: SBI-016857
Synonyms 4-{[(E)-(3,4-dimethoxyphenyl)methylidene]amino}-5-(3-methylphenyl)-4H-1,2,4-triazol-3-yl hydrosulfide4-{[(3,4-dimethoxyphenyl)methylidene]amino}-5-(3-methylphenyl)-4H-1,2,4-triazole-3-thiol
Temperature 315 °C