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

View entire compound with spectra: 1 NMR

4H-1,2,4-triazole-3-thiol, 5-(5-bromo-3-pyridinyl)-4-(2-fluorophenyl)-
SpectraBase Compound ID 2BO8qc4swqQ
InChI InChI=1S/C13H8BrFN4S/c14-9-5-8(6-16-7-9)12-17-18-13(20)19(12)11-4-2-1-3-10(11)15/h1-7H,(H,18,20)
InChIKey YDBKLUOIUGMMAJ-UHFFFAOYSA-N
Mol Weight 351.2 g/mol
Molecular Formula C13H8BrFN4S
Exact Mass 349.963709 g/mol

1H Nuclear Magnetic Resonance (NMR) Spectrum

1H Nuclear Magnetic Resonance (NMR) Spectrum

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SpectraBase Spectrum ID L51RwN2S6P5
Name 4H-1,2,4-triazole-3-thiol, 5-(5-bromo-3-pyridinyl)-4-(2-fluorophenyl)-
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/C13H8BrFN4S/c14-9-5-8(6-16-7-9)12-17-18-13(20)19(12)11-4-2-1-3-10(11)15/h1-7H,(H,18,20)
InChIKey YDBKLUOIUGMMAJ-UHFFFAOYSA-N
NMR Offset 18.0068
NMR Spectrometer Frequency 500.134
Observed nucleus 1H
Origin 1H_ASIOH_7529_5664
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/18217096