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

View entire compound with spectra: 1 NMR

4H-1,2,4-triazole-3-thiol, 5-(4-bromophenyl)-4-(3-pyridinyl)-
SpectraBase Compound ID FEf5EO9Y12u
InChI InChI=1S/C13H9BrN4S/c14-10-5-3-9(4-6-10)12-16-17-13(19)18(12)11-2-1-7-15-8-11/h1-8H,(H,17,19)
InChIKey LTCDLTLOHRZRGS-UHFFFAOYSA-N
Mol Weight 333.21 g/mol
Molecular Formula C13H9BrN4S
Exact Mass 331.97313 g/mol

1H Nuclear Magnetic Resonance (NMR) Spectrum

1H Nuclear Magnetic Resonance (NMR) Spectrum

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SpectraBase Spectrum ID K1OJog3UE64
Name 4H-1,2,4-triazole-3-thiol, 5-(4-bromophenyl)-4-(3-pyridinyl)-
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/C13H9BrN4S/c14-10-5-3-9(4-6-10)12-16-17-13(19)18(12)11-2-1-7-15-8-11/h1-8H,(H,17,19)
InChIKey LTCDLTLOHRZRGS-UHFFFAOYSA-N
NMR Offset 15.5012
NMR Spectrometer Frequency 300.135
Observed nucleus 1H
Origin 1H_SBI_11628_4864
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: F23349; Labnumber: NNOBK-9085