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3-(2-Chloranyl-4-methyl-phenyl)-4-phenyl-1H-1,2,4-triazole-5-thione
SpectraBase Compound ID AyqduMYvcA0
InChI InChI=1S/C15H12ClN3S/c1-10-7-8-12(13(16)9-10)14-17-18-15(20)19(14)11-5-3-2-4-6-11/h2-9H,1H3,(H,18,20)
InChIKey IQRNQKGUGZTTPR-UHFFFAOYSA-N
Mol Weight 301.79 g/mol
Molecular Formula C15H12ClN3S
Exact Mass 301.044046 g/mol

1H Nuclear Magnetic Resonance (NMR) Spectrum

1H Nuclear Magnetic Resonance (NMR) Spectrum

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SpectraBase Spectrum ID GtWLodFWgvg
Name 4H-1,2,4-triazole-3-thiol, 5-(2-chloro-4-methylphenyl)-4-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/C15H12ClN3S/c1-10-7-8-12(13(16)9-10)14-17-18-15(20)19(14)11-5-3-2-4-6-11/h2-9H,1H3,(H,18,20)
InChIKey IQRNQKGUGZTTPR-UHFFFAOYSA-N
NMR Offset 18.0068
NMR Spectrometer Frequency 500.134
Observed nucleus 1H
Origin 1H_ASIOH_7529_3776
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/17231854; Labnumber: c_bloc-498