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3-(4-methoxybenzyl)-6-(4-pyridinyl)[1,2,4]triazolo[3,4-b][1,3,4]thiadiazole
SpectraBase Compound ID GCuU8GyjkOG
InChI InChI=1S/C16H13N5OS/c1-22-13-4-2-11(3-5-13)10-14-18-19-16-21(14)20-15(23-16)12-6-8-17-9-7-12/h2-9H,10H2,1H3
InChIKey ZLDARKZVIWKPJV-UHFFFAOYSA-N
Mol Weight 323.37 g/mol
Molecular Formula C16H13N5OS
Exact Mass 323.084081 g/mol

1H Nuclear Magnetic Resonance (NMR) Spectrum

1H Nuclear Magnetic Resonance (NMR) Spectrum

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SpectraBase Spectrum ID JUXXqygm16Y
Name 3-(4-methoxybenzyl)-6-(4-pyridinyl)[1,2,4]triazolo[3,4-b][1,3,4]thiadiazole
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/C16H13N5OS/c1-22-13-4-2-11(3-5-13)10-14-18-19-16-21(14)20-15(23-16)12-6-8-17-9-7-12/h2-9H,10H2,1H3
InChIKey ZLDARKZVIWKPJV-UHFFFAOYSA-N
NMR Offset 15.449
NMR Spectrometer Frequency 300.135
Observed nucleus 1H
Origin 1H_SBI_36227_35503
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: E91103; SBI_ID: SBI-035507
Synonyms methyl 4-{[6-(4-pyridinyl)[1,2,4]triazolo[3,4-b][1,3,4]thiadiazol-3-yl]methyl}phenyl ether
Temperature 308 °C