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benzoic acid, 3-[[3-mercapto-5-(2-quinolinyl)-4H-1,2,4-triazol-4-yl]methyl]-
SpectraBase Compound ID 7FF5SH4bvDp
InChI InChI=1S/C19H14N4O2S/c24-18(25)14-6-3-4-12(10-14)11-23-17(21-22-19(23)26)16-9-8-13-5-1-2-7-15(13)20-16/h1-10H,11H2,(H,22,26)(H,24,25)
InChIKey QHANQUAWTXMZOZ-UHFFFAOYSA-N
Mol Weight 362.41 g/mol
Molecular Formula C19H14N4O2S
Exact Mass 362.083747 g/mol

1H Nuclear Magnetic Resonance (NMR) Spectrum

1H Nuclear Magnetic Resonance (NMR) Spectrum

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SpectraBase Spectrum ID 1wDOIqDi12E
Name benzoic acid, 3-[[3-mercapto-5-(2-quinolinyl)-4H-1,2,4-triazol-4-yl]methyl]-
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/C19H14N4O2S/c24-18(25)14-6-3-4-12(10-14)11-23-17(21-22-19(23)26)16-9-8-13-5-1-2-7-15(13)20-16/h1-10H,11H2,(H,22,26)(H,24,25)
InChIKey QHANQUAWTXMZOZ-UHFFFAOYSA-N
NMR Offset 18.0068
NMR Spectrometer Frequency 500.134
Observed nucleus 1H
Origin 1H_ASIOH_7529_5830
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: NMR/18217304; Labnumber: OBK-8312