For citations & permissions, please see: Citations & Permissions - Wiley Science Solutions*

*Links on SpectraBase are not permalinks.

[1,2,4]triazolo[3,4-b][1,3,4]thiadiazole, 6-(3-chloro-4-fluorophenyl)-3-[(3,4-dimethoxyphenyl)methyl]-

View entire compound with spectra: 1 NMR

[1,2,4]triazolo[3,4-b][1,3,4]thiadiazole, 6-(3-chloro-4-fluorophenyl)-3-[(3,4-dimethoxyphenyl)methyl]-
SpectraBase Compound ID 5jUf0Dr7wfD
InChI InChI=1S/C18H14ClFN4O2S/c1-25-14-6-3-10(7-15(14)26-2)8-16-21-22-18-24(16)23-17(27-18)11-4-5-13(20)12(19)9-11/h3-7,9H,8H2,1-2H3
InChIKey LCBICRQTNKTTPN-UHFFFAOYSA-N
Mol Weight 404.85 g/mol
Molecular Formula C18H14ClFN4O2S
Exact Mass 404.051003 g/mol

1H Nuclear Magnetic Resonance (NMR) Spectrum

1H Nuclear Magnetic Resonance (NMR) Spectrum

View the Full Spectrum for FREE!

The full spectrum can only be viewed using a FREE account.

SpectraBase Spectrum ID LKi9U5YRCOu
Name [1,2,4]triazolo[3,4-b][1,3,4]thiadiazole, 6-(3-chloro-4-fluorophenyl)-3-[(3,4-dimethoxyphenyl)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/C18H14ClFN4O2S/c1-25-14-6-3-10(7-15(14)26-2)8-16-21-22-18-24(16)23-17(27-18)11-4-5-13(20)12(19)9-11/h3-7,9H,8H2,1-2H3
InChIKey LCBICRQTNKTTPN-UHFFFAOYSA-N
NMR Offset 15.5012
NMR Spectrometer Frequency 300.135
Observed nucleus 1H
Origin 1H_SBI_11628_5614
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: F26079; Labnumber: BAL4-9501