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5-(4-pyridyl)-1H-1,2,4-triazole-3-thiol

View entire compound with spectra: 6 NMR, 2 FTIR, and 3 UV-Vis

5-(4-pyridyl)-1H-1,2,4-triazole-3-thiol
SpectraBase Compound ID E3AI1gLbTHy
InChI InChI=1S/C7H6N4S/c12-7-9-6(10-11-7)5-1-3-8-4-2-5/h1-4H,(H2,9,10,11,12)
InChIKey PBTAXYKMCKLQSM-UHFFFAOYSA-N
Mol Weight 178.21 g/mol
Molecular Formula C7H6N4S
Exact Mass 178.031317 g/mol

1H Nuclear Magnetic Resonance (NMR) Spectrum

1H Nuclear Magnetic Resonance (NMR) Spectrum

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SpectraBase Spectrum ID 2k4mdjnHL6P
Name 5-(4-pyridinyl)-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/C7H6N4S/c12-7-9-6(10-11-7)5-1-3-8-4-2-5/h1-4H,(H2,9,10,11,12)
InChIKey PBTAXYKMCKLQSM-UHFFFAOYSA-N
NMR Offset 15.449
NMR Spectrometer Frequency 300.135
Observed nucleus 1H
Origin 1H_SBI_36227_13612
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: D86398; Labnumber: NNOBK-5550; SBI_ID: SBI-013615
Synonyms 5-(4-pyridinyl)-4H-1,2,4-triazol-3-yl hydrosulfide
Temperature 308 °C