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

View entire compound with spectra: 1 NMR

4-(4-chloro-2-methylphenyl)-5-(3-pyridinyl)-4H-1,2,4-triazole-3-thiol
SpectraBase Compound ID 41ShbDNY5k2
InChI InChI=1S/C14H11ClN4S/c1-9-7-11(15)4-5-12(9)19-13(17-18-14(19)20)10-3-2-6-16-8-10/h2-8H,1H3,(H,18,20)
InChIKey JLBPXUCAICWTFJ-UHFFFAOYSA-N
Mol Weight 302.78 g/mol
Molecular Formula C14H11ClN4S
Exact Mass 302.039295 g/mol

1H Nuclear Magnetic Resonance (NMR) Spectrum

1H Nuclear Magnetic Resonance (NMR) Spectrum

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SpectraBase Spectrum ID 4R8G5PEg4sr
Name 4-(4-chloro-2-methylphenyl)-5-(3-pyridinyl)-4H-1,2,4-triazole-3-thiol
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/C14H11ClN4S/c1-9-7-11(15)4-5-12(9)19-13(17-18-14(19)20)10-3-2-6-16-8-10/h2-8H,1H3,(H,18,20)
InChIKey JLBPXUCAICWTFJ-UHFFFAOYSA-N
NMR Offset 15.449
NMR Spectrometer Frequency 300.135
Observed nucleus 1H
Origin 1H_SBI_36227_18094
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: D31807; Labnumber: VGU-0022567; SBI_ID: SBI-018097
Synonyms 4-(4-chloro-2-methylphenyl)-5-(3-pyridinyl)-4H-1,2,4-triazol-3-yl hydrosulfide
Temperature 308 °C