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

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4-(2-chlorophenyl)-5-(2-pyrazinyl)-4H-1,2,4-triazole-3-thiol
SpectraBase Compound ID 8DAlJDIKASJ
InChI InChI=1S/C12H8ClN5S/c13-8-3-1-2-4-10(8)18-11(16-17-12(18)19)9-7-14-5-6-15-9/h1-7H,(H,17,19)
InChIKey KIBTXAFJLFRSFN-UHFFFAOYSA-N
Mol Weight 289.74 g/mol
Molecular Formula C12H8ClN5S
Exact Mass 289.018894 g/mol

1H Nuclear Magnetic Resonance (NMR) Spectrum

1H Nuclear Magnetic Resonance (NMR) Spectrum

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SpectraBase Spectrum ID 8U8NM9hA5GH
Name 4-(2-chlorophenyl)-5-(2-pyrazinyl)-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/C12H8ClN5S/c13-8-3-1-2-4-10(8)18-11(16-17-12(18)19)9-7-14-5-6-15-9/h1-7H,(H,17,19)
InChIKey KIBTXAFJLFRSFN-UHFFFAOYSA-N
NMR Offset 18.0059
NMR Spectrometer Frequency 300.135
Observed nucleus 1H
Origin 1H_SBI_36227_2556
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: D03655; Labnumber: NCOBK-0368; SBI_ID: SBI-002558
Synonyms 4-(2-chlorophenyl)-5-(2-pyrazinyl)-4H-1,2,4-triazol-3-yl hydrosulfide
Temperature 308 °C