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4-benzyl-5-(2-quinolinyl)-2,4-dihydro-3H-1,2,4-triazole-3-thione
SpectraBase Compound ID 33FJKgXDiQ6
InChI InChI=1S/C18H14N4S/c23-18-21-20-17(22(18)12-13-6-2-1-3-7-13)16-11-10-14-8-4-5-9-15(14)19-16/h1-11H,12H2,(H,21,23)
InChIKey WKKGAWDDMRVQJC-UHFFFAOYSA-N
Mol Weight 318.4 g/mol
Molecular Formula C18H14N4S
Exact Mass 318.093918 g/mol

1H Nuclear Magnetic Resonance (NMR) Spectrum

1H Nuclear Magnetic Resonance (NMR) Spectrum

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SpectraBase Spectrum ID G3FmwKkKemB
Name 4-benzyl-5-(2-quinolinyl)-2,4-dihydro-3H-1,2,4-triazole-3-thione
Copyright Copyright © 2022-2024 Chemical Block, Russia, Leninsky Prospect 47 - Database Compilation Copyright © 2022-2024 John Wiley & Sons, Inc. All Rights Reserved.
Exact Mass 318.093917641 u
Formula C18H14N4S
InChI InChI=1S/C18H14N4S/c23-18-21-20-17(22(18)12-13-6-2-1-3-7-13)16-11-10-14-8-4-5-9-15(14)19-16/h1-11H,12H2,(H,21,23)
InChIKey WKKGAWDDMRVQJC-UHFFFAOYSA-N
Molecular Weight 318.398 g/mol
NMR Offset 18.0068
NMR Spectrometer Frequency 500.134
Observed nucleus 1H
Sample State Soluted
Sample_ID 1H_CB_2020_4468
Solvent DMSO-d6
Source Vendor ID: NMR/12309410