3-(4-methoxybenzyl)-6-(4-nitrophenyl)[1,2,4]triazolo[3,4-b][1,3,4]thiadiazole

SpectraBase Compound ID	9XDhVyqSFwF
InChI	InChI=1S/C17H13N5O3S/c1-25-14-8-2-11(3-9-14)10-15-18-19-17-21(15)20-16(26-17)12-4-6-13(7-5-12)22(23)24/h2-9H,10H2,1H3
InChIKey	JIGKQVLEQPNFPC-UHFFFAOYSA-N Google Search
Mol Weight	367.38 g/mol
Molecular Formula	C17H13N5O3S
Exact Mass	367.07391 g/mol

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SpectraBase Spectrum ID	9UU93wLZJwi
Name	3-(4-methoxybenzyl)-6-(4-nitrophenyl)[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/C17H13N5O3S/c1-25-14-8-2-11(3-9-14)10-15-18-19-17-21(15)20-16(26-17)12-4-6-13(7-5-12)22(23)24/h2-9H,10H2,1H3
InChIKey	JIGKQVLEQPNFPC-UHFFFAOYSA-N
NMR Offset	15.449
NMR Spectrometer Frequency	300.135
Observed nucleus	1H
Origin	1H_SBI_36227_35488
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: E91087; SBI_ID: SBI-035492
Synonyms	methyl 4-{[6-(4-nitrophenyl)[1,2,4]triazolo[3,4-b][1,3,4]thiadiazol-3-yl]methyl}phenyl ether
Temperature	308 °C