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4-{[(E)-(2,3-dimethoxyphenyl)methylidene]amino}-5-(3-methyl-1H-pyrazol-5-yl)-4H-1,2,4-triazole-3-thiol
SpectraBase Compound ID 2Lq0lpM82qD
InChI InChI=1S/C15H16N6O2S/c1-9-7-11(18-17-9)14-19-20-15(24)21(14)16-8-10-5-4-6-12(22-2)13(10)23-3/h4-8H,1-3H3,(H,17,18)(H,20,24)/b16-8+
InChIKey SIXRKWYQNDFFSK-LZYBPNLTSA-N
Mol Weight 344.39 g/mol
Molecular Formula C15H16N6O2S
Exact Mass 344.105545 g/mol

1H Nuclear Magnetic Resonance (NMR) Spectrum

1H Nuclear Magnetic Resonance (NMR) Spectrum

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SpectraBase Spectrum ID 34SqKjYClY2
Name 4-{[(E)-(2,3-dimethoxyphenyl)methylidene]amino}-5-(3-methyl-1H-pyrazol-5-yl)-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/C15H16N6O2S/c1-9-7-11(18-17-9)14-19-20-15(24)21(14)16-8-10-5-4-6-12(22-2)13(10)23-3/h4-8H,1-3H3,(H,17,18)(H,20,24)/b16-8+
InChIKey SIXRKWYQNDFFSK-LZYBPNLTSA-N
NMR Offset 15.328
NMR Spectrometer Frequency 300.135
Observed nucleus 1H
Origin 1H_SBI_36227_4011
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: E00497; Labnumber: GRES-08984; SBI_ID: SBI-004013
Synonyms 4-{[(E)-(2,3-dimethoxyphenyl)methylidene]amino}-5-(3-methyl-1H-pyrazol-5-yl)-4H-1,2,4-triazol-3-yl hydrosulfide4-{[(2,3-dimethoxyphenyl)methylidene]amino}-5-(3-methyl-1H-pyrazol-5-yl)-4H-1,2,4-triazole-3-thiol
Temperature 318 °C