7H-[1,2,4]triazolo[3,4-b][1,3,4]thiadiazinium, 6-(4-bromophenyl)-3-(1-methylethyl)-, bromide

SpectraBase Compound ID	2vs64kdqlci
InChI	InChI=1S/C13H13BrN4S.BrH/c1-8(2)12-15-16-13-18(12)17-11(7-19-13)9-3-5-10(14)6-4-9;/h3-6,8H,7H2,1-2H3;1H
InChIKey	YFGFAWMRJGFJGP-UHFFFAOYSA-N Google Search
Mol Weight	418.15 g/mol
Molecular Formula	C13H14Br2N4S
Exact Mass	415.930594 g/mol

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SpectraBase Spectrum ID	AHAmNnl1qfB
Name	7H-[1,2,4]triazolo[3,4-b][1,3,4]thiadiazinium, 6-(4-bromophenyl)-3-(1-methylethyl)-, bromide
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/C13H13BrN4S.BrH/c1-8(2)12-15-16-13-18(12)17-11(7-19-13)9-3-5-10(14)6-4-9;/h3-6,8H,7H2,1-2H3;1H
InChIKey	YFGFAWMRJGFJGP-UHFFFAOYSA-N
NMR Offset	18.0068
NMR Spectrometer Frequency	500.134
Observed nucleus	1H
Origin	1H_ASIOH_7529_5662
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/18217089