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4H-1,2,4-triazole, 3-[[(6-chloro-4H-1,3-benzodioxin-8-yl)methyl]thio]-4,5-diphenyl-
SpectraBase Compound ID fIGcUHxLFV
InChI InChI=1S/C23H18ClN3O2S/c24-19-11-17-13-28-15-29-21(17)18(12-19)14-30-23-26-25-22(16-7-3-1-4-8-16)27(23)20-9-5-2-6-10-20/h1-12H,13-15H2
InChIKey YBJVSUNUSLCMID-UHFFFAOYSA-N
Mol Weight 435.93 g/mol
Molecular Formula C23H18ClN3O2S
Exact Mass 435.080826 g/mol

1H Nuclear Magnetic Resonance (NMR) Spectrum

1H Nuclear Magnetic Resonance (NMR) Spectrum

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SpectraBase Spectrum ID IDMQZkvlJq8
Name 4H-1,2,4-triazole, 3-[[(6-chloro-4H-1,3-benzodioxin-8-yl)methyl]thio]-4,5-diphenyl-
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/C23H18ClN3O2S/c24-19-11-17-13-28-15-29-21(17)18(12-19)14-30-23-26-25-22(16-7-3-1-4-8-16)27(23)20-9-5-2-6-10-20/h1-12H,13-15H2
InChIKey YBJVSUNUSLCMID-UHFFFAOYSA-N
NMR Offset 18.0068
NMR Spectrometer Frequency 500.134
Observed nucleus 1H
Origin 1H_CB_8313_6956
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/10322549; Labnumber: LP-2101842