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[1,2,4]triazolo[3,4-b][1,3,4]thiadiazole, 6-[2-(3,5-dimethyl-1-phenyl-1H-pyrazol-4-yl)ethyl]-3-(3-pyridinyl)-
SpectraBase Compound ID BRlbuYLoF8W
InChI InChI=1S/C21H19N7S/c1-14-18(15(2)27(25-14)17-8-4-3-5-9-17)10-11-19-26-28-20(23-24-21(28)29-19)16-7-6-12-22-13-16/h3-9,12-13H,10-11H2,1-2H3
InChIKey PEYYQOQABMEBGH-UHFFFAOYSA-N
Mol Weight 401.49 g/mol
Molecular Formula C21H19N7S
Exact Mass 401.142265 g/mol

1H Nuclear Magnetic Resonance (NMR) Spectrum

1H Nuclear Magnetic Resonance (NMR) Spectrum

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SpectraBase Spectrum ID G60wgQUZhSY
Name [1,2,4]triazolo[3,4-b][1,3,4]thiadiazole, 6-[2-(3,5-dimethyl-1-phenyl-1H-pyrazol-4-yl)ethyl]-3-(3-pyridinyl)-
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/C21H19N7S/c1-14-18(15(2)27(25-14)17-8-4-3-5-9-17)10-11-19-26-28-20(23-24-21(28)29-19)16-7-6-12-22-13-16/h3-9,12-13H,10-11H2,1-2H3
InChIKey PEYYQOQABMEBGH-UHFFFAOYSA-N
NMR Offset 15.5012
NMR Spectrometer Frequency 300.135
Observed nucleus 1H
Origin 1H_SBI_11628_3399
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: F17640; Labnumber: BAL4-9328