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5,5'-methylenebis(4-benzyl-4H-1,2,4-triazole-3-thiol)

View entire compound with spectra: 1 NMR

5,5'-methylenebis(4-benzyl-4H-1,2,4-triazole-3-thiol)
SpectraBase Compound ID C78U3gTe9lF
InChI InChI=1S/C19H18N6S2/c26-18-22-20-16(24(18)12-14-7-3-1-4-8-14)11-17-21-23-19(27)25(17)13-15-9-5-2-6-10-15/h1-10H,11-13H2,(H,22,26)(H,23,27)
InChIKey PKDMQHNYBQEXKL-UHFFFAOYSA-N
Mol Weight 394.52 g/mol
Molecular Formula C19H18N6S2
Exact Mass 394.103437 g/mol

1H Nuclear Magnetic Resonance (NMR) Spectrum

1H Nuclear Magnetic Resonance (NMR) Spectrum

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SpectraBase Spectrum ID GqwoB3MMuKf
Name 5,5'-methylenebis(4-benzyl-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/C19H18N6S2/c26-18-22-20-16(24(18)12-14-7-3-1-4-8-14)11-17-21-23-19(27)25(17)13-15-9-5-2-6-10-15/h1-10H,11-13H2,(H,22,26)(H,23,27)
InChIKey PKDMQHNYBQEXKL-UHFFFAOYSA-N
NMR Offset 18.0068
NMR Spectrometer Frequency 500.134
Observed nucleus 1H
Origin 1H_ASIOH_7529_3757
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/17231800; Labnumber: c_bloc-438