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5-[2-(2,5-dimethylphenyl)-4-quinolinyl]-4-ethyl-4H-1,2,4-triazole-3-thiol

View entire compound with spectra: 1 NMR

5-[2-(2,5-dimethylphenyl)-4-quinolinyl]-4-ethyl-4H-1,2,4-triazole-3-thiol
SpectraBase Compound ID JDVvSBjZ2oh
InChI InChI=1S/C21H20N4S/c1-4-25-20(23-24-21(25)26)17-12-19(16-11-13(2)9-10-14(16)3)22-18-8-6-5-7-15(17)18/h5-12H,4H2,1-3H3,(H,24,26)
InChIKey WJLOORLELDRJHW-UHFFFAOYSA-N
Mol Weight 360.48 g/mol
Molecular Formula C21H20N4S
Exact Mass 360.140868 g/mol

1H Nuclear Magnetic Resonance (NMR) Spectrum

1H Nuclear Magnetic Resonance (NMR) Spectrum

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SpectraBase Spectrum ID Fujdu9qPapp
Name 5-[2-(2,5-dimethylphenyl)-4-quinolinyl]-4-ethyl-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/C21H20N4S/c1-4-25-20(23-24-21(25)26)17-12-19(16-11-13(2)9-10-14(16)3)22-18-8-6-5-7-15(17)18/h5-12H,4H2,1-3H3,(H,24,26)
InChIKey WJLOORLELDRJHW-UHFFFAOYSA-N
NMR Offset 15.328
NMR Spectrometer Frequency 300.135
Observed nucleus 1H
Origin 1H_UZI_26187_6546
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/1026032; Labnumber: COL1820; UZI_ID: UZI-006548
Synonyms 5-[2-(2,5-dimethylphenyl)-4-quinolinyl]-4-ethyl-4H-1,2,4-triazol-3-yl hydrosulfide
Temperature 318 °C