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5-[2-(4-chlorophenyl)-4-quinolinyl]-4-methyl-4H-1,2,4-triazole-3-thiol
SpectraBase Compound ID 8emlVkcNkuk
InChI InChI=1S/C18H13ClN4S/c1-23-17(21-22-18(23)24)14-10-16(11-6-8-12(19)9-7-11)20-15-5-3-2-4-13(14)15/h2-10H,1H3,(H,22,24)
InChIKey LPHQAVFIGPAZJS-UHFFFAOYSA-N
Mol Weight 352.84 g/mol
Molecular Formula C18H13ClN4S
Exact Mass 352.054945 g/mol

1H Nuclear Magnetic Resonance (NMR) Spectrum

1H Nuclear Magnetic Resonance (NMR) Spectrum

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SpectraBase Spectrum ID 9u6atxZCMxe
Name 5-[2-(4-chlorophenyl)-4-quinolinyl]-4-methyl-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/C18H13ClN4S/c1-23-17(21-22-18(23)24)14-10-16(11-6-8-12(19)9-7-11)20-15-5-3-2-4-13(14)15/h2-10H,1H3,(H,22,24)
InChIKey LPHQAVFIGPAZJS-UHFFFAOYSA-N
NMR Offset 15.328
NMR Spectrometer Frequency 300.135
Observed nucleus 1H
Origin 1H_UZI_26187_6851
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: UZI/1266902; Labnumber: COL3599; UZI_ID: UZI-006853
Synonyms 5-[2-(4-chlorophenyl)-4-quinolinyl]-4-methyl-4H-1,2,4-triazol-3-yl hydrosulfide
Temperature 318 °C