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4-methyl-5-[2-(4-pyridinyl)-4-quinolinyl]-4H-1,2,4-triazole-3-thiol
SpectraBase Compound ID D33ao36C4gB
InChI InChI=1S/C17H13N5S/c1-22-16(20-21-17(22)23)13-10-15(11-6-8-18-9-7-11)19-14-5-3-2-4-12(13)14/h2-10H,1H3,(H,21,23)
InChIKey CODFZJRAWCPXSN-UHFFFAOYSA-N
Mol Weight 319.39 g/mol
Molecular Formula C17H13N5S
Exact Mass 319.089167 g/mol

1H Nuclear Magnetic Resonance (NMR) Spectrum

1H Nuclear Magnetic Resonance (NMR) Spectrum

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SpectraBase Spectrum ID 1mv2y1OecDF
Name 4-methyl-5-[2-(4-pyridinyl)-4-quinolinyl]-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/C17H13N5S/c1-22-16(20-21-17(22)23)13-10-15(11-6-8-18-9-7-11)19-14-5-3-2-4-12(13)14/h2-10H,1H3,(H,21,23)
InChIKey CODFZJRAWCPXSN-UHFFFAOYSA-N
NMR Offset 15.328
NMR Spectrometer Frequency 300.135
Observed nucleus 1H
Origin 1H_UZI_26187_6849
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/1265483; Labnumber: COL3596; UZI_ID: UZI-006851
Synonyms 4-methyl-5-[2-(4-pyridinyl)-4-quinolinyl]-4H-1,2,4-triazol-3-yl hydrosulfide
Temperature 318 °C