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4H-1,2,4-triazole-3-thiol, 5-(1,3-benzodioxol-5-yl)-4-(5-quinolinyl)-

View entire compound with spectra: 1 NMR

4H-1,2,4-triazole-3-thiol, 5-(1,3-benzodioxol-5-yl)-4-(5-quinolinyl)-
SpectraBase Compound ID G3N7C23dEik
InChI InChI=1S/C18H12N4O2S/c25-18-21-20-17(11-6-7-15-16(9-11)24-10-23-15)22(18)14-5-1-4-13-12(14)3-2-8-19-13/h1-9H,10H2,(H,21,25)
InChIKey DVZXBSYDCOAWDC-UHFFFAOYSA-N
Mol Weight 348.38 g/mol
Molecular Formula C18H12N4O2S
Exact Mass 348.068097 g/mol

1H Nuclear Magnetic Resonance (NMR) Spectrum

1H Nuclear Magnetic Resonance (NMR) Spectrum

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SpectraBase Spectrum ID GkD2DY4NhRG
Name 4H-1,2,4-triazole-3-thiol, 5-(1,3-benzodioxol-5-yl)-4-(5-quinolinyl)-
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/C18H12N4O2S/c25-18-21-20-17(11-6-7-15-16(9-11)24-10-23-15)22(18)14-5-1-4-13-12(14)3-2-8-19-13/h1-9H,10H2,(H,21,25)
InChIKey DVZXBSYDCOAWDC-UHFFFAOYSA-N
NMR Offset 15.449
NMR Spectrometer Frequency 300.135
Observed nucleus 1H
Origin 1H_SBI_11628_273
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: F03872; Labnumber: NNOBK-8261
Temperature 308 °C