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

View entire compound with spectra: 1 NMR, and 1 MS (GC)

4-(4-Methoxyphenyl)-5-(4-pyridinyl)-4H-1,2,4-triazole-3-thiol
SpectraBase Compound ID HFZf2kVuLF1
InChI InChI=1S/C14H12N4OS/c1-19-12-4-2-11(3-5-12)18-13(16-17-14(18)20)10-6-8-15-9-7-10/h2-9H,1H3,(H,17,20)
InChIKey MBKUEKQPGNCQRO-UHFFFAOYSA-N
Mol Weight 284.34 g/mol
Molecular Formula C14H12N4OS
Exact Mass 284.073182 g/mol

1H Nuclear Magnetic Resonance (NMR) Spectrum

1H Nuclear Magnetic Resonance (NMR) Spectrum

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SpectraBase Spectrum ID BjzeqHzwQ9u
Name 4H-1,2,4-triazole-3-thiol, 4-(4-methoxyphenyl)-5-(4-pyridinyl)-
Copyright Copyright © 2022-2024 Chemical Block, Russia, Leninsky Prospect 47 - Database Compilation Copyright © 2022-2024 John Wiley & Sons, Inc. All Rights Reserved.
Exact Mass 284.073182195 u
Formula C14H12N4OS
InChI InChI=1S/C14H12N4OS/c1-19-12-4-2-11(3-5-12)18-13(16-17-14(18)20)10-6-8-15-9-7-10/h2-9H,1H3,(H,17,20)
InChIKey MBKUEKQPGNCQRO-UHFFFAOYSA-N
Molecular Weight 284.337 g/mol
NMR Offset 17.0068
NMR Spectrometer Frequency 500.134
Observed nucleus 1H
Sample State Soluted
Sample_ID 1H_CB_2017_8481
Solvent DMSO-d6
Source Vendor ID: NMR/9322834; Lab Info: PE; Lab Number: PE-0129943