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5-[2-(4-isopropylphenyl)-6-methyl-4-quinolinyl]-4-methyl-4H-1,2,4-triazole-3-thiol
SpectraBase Compound ID 3sOm1KtPymt
InChI InChI=1S/C22H22N4S/c1-13(2)15-6-8-16(9-7-15)20-12-18(21-24-25-22(27)26(21)4)17-11-14(3)5-10-19(17)23-20/h5-13H,1-4H3,(H,25,27)
InChIKey DECBZOKEYFIAOL-UHFFFAOYSA-N
Mol Weight 374.51 g/mol
Molecular Formula C22H22N4S
Exact Mass 374.156518 g/mol

1H Nuclear Magnetic Resonance (NMR) Spectrum

1H Nuclear Magnetic Resonance (NMR) Spectrum

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SpectraBase Spectrum ID An2D3ImuwfR
Name 5-[2-(4-isopropylphenyl)-6-methyl-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/C22H22N4S/c1-13(2)15-6-8-16(9-7-15)20-12-18(21-24-25-22(27)26(21)4)17-11-14(3)5-10-19(17)23-20/h5-13H,1-4H3,(H,25,27)
InChIKey DECBZOKEYFIAOL-UHFFFAOYSA-N
NMR Offset 15.328
NMR Spectrometer Frequency 300.135
Observed nucleus 1H
Origin 1H_UZI_26187_6755
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/1267083; Labnumber: COL3371; UZI_ID: UZI-006757
Synonyms 5-[2-(4-isopropylphenyl)-6-methyl-4-quinolinyl]-4-methyl-4H-1,2,4-triazol-3-yl hydrosulfide
Temperature 318 °C