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4H-1,2,4-triazole-3-thiol, 4-(3-pyridinyl)-5-(3,4,5-trimethoxyphenyl)-
SpectraBase Compound ID 977zza3Nw28
InChI InChI=1S/C16H16N4O3S/c1-21-12-7-10(8-13(22-2)14(12)23-3)15-18-19-16(24)20(15)11-5-4-6-17-9-11/h4-9H,1-3H3,(H,19,24)
InChIKey GNUMNUMASXUDKD-UHFFFAOYSA-N
Mol Weight 344.39 g/mol
Molecular Formula C16H16N4O3S
Exact Mass 344.094312 g/mol

1H Nuclear Magnetic Resonance (NMR) Spectrum

1H Nuclear Magnetic Resonance (NMR) Spectrum

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SpectraBase Spectrum ID 9Yp9GC1Lofs
Name 4H-1,2,4-triazole-3-thiol, 4-(3-pyridinyl)-5-(3,4,5-trimethoxyphenyl)-
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/C16H16N4O3S/c1-21-12-7-10(8-13(22-2)14(12)23-3)15-18-19-16(24)20(15)11-5-4-6-17-9-11/h4-9H,1-3H3,(H,19,24)
InChIKey GNUMNUMASXUDKD-UHFFFAOYSA-N
NMR Offset 15.5012
NMR Spectrometer Frequency 300.135
Observed nucleus 1H
Origin 1H_SBI_11628_1813
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: F13042; Labnumber: NNOBK-9140