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4H-1,2,4-triazole-3-thiol, 5-pyrazinyl-4-[4-(1H-1,2,4-triazol-1-ylmethyl)phenyl]-
SpectraBase Compound ID 6vSNz3FpnGh
InChI InChI=1S/C15H12N8S/c24-15-21-20-14(13-7-16-5-6-18-13)23(15)12-3-1-11(2-4-12)8-22-10-17-9-19-22/h1-7,9-10H,8H2,(H,21,24)
InChIKey CUWCWTLXMGQGCD-UHFFFAOYSA-N
Mol Weight 336.38 g/mol
Molecular Formula C15H12N8S
Exact Mass 336.090564 g/mol

1H Nuclear Magnetic Resonance (NMR) Spectrum

1H Nuclear Magnetic Resonance (NMR) Spectrum

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SpectraBase Spectrum ID JAcFva46ArV
Name 4H-1,2,4-triazole-3-thiol, 5-pyrazinyl-4-[4-(1H-1,2,4-triazol-1-ylmethyl)phenyl]-
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/C15H12N8S/c24-15-21-20-14(13-7-16-5-6-18-13)23(15)12-3-1-11(2-4-12)8-22-10-17-9-19-22/h1-7,9-10H,8H2,(H,21,24)
InChIKey CUWCWTLXMGQGCD-UHFFFAOYSA-N
NMR Offset 18.0068
NMR Spectrometer Frequency 500.134
Observed nucleus 1H
Origin 1H_ASIOH_7529_6969
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: NMR/18277185; Labnumber: OBK-8549