1-[2-(4-methoxyphenyl)-2-oxoethyl]-3-(4-pyridinyl)-6,7-dihydro-5H-pyrrolo[1,2-d][1,2,4]triazol-1-ium bromide

SpectraBase Compound ID	KbSNy9IcVrO
InChI	InChI=1S/C19H19N4O2.BrH/c1-25-16-6-4-14(5-7-16)17(24)13-23-18-3-2-12-22(18)19(21-23)15-8-10-20-11-9-15;/h4-11H,2-3,12-13H2,1H3;1H/q+1;/p-1
InChIKey	RUFAJTNIFYLSBI-UHFFFAOYSA-M Google Search
Mol Weight	415.29 g/mol
Molecular Formula	C19H19BrN4O2
Exact Mass	414.069139 g/mol

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SpectraBase Spectrum ID	DlkGOy7Zwvz
Name	1-[2-(4-methoxyphenyl)-2-oxoethyl]-3-(4-pyridinyl)-6,7-dihydro-5H-pyrrolo[1,2-d][1,2,4]triazol-1-ium 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/C19H19N4O2.BrH/c1-25-16-6-4-14(5-7-16)17(24)13-23-18-3-2-12-22(18)19(21-23)15-8-10-20-11-9-15;/h4-11H,2-3,12-13H2,1H3;1H/q+1;/p-1
InChIKey	RUFAJTNIFYLSBI-UHFFFAOYSA-M
NMR Offset	15.328
NMR Spectrometer Frequency	300.135
Observed nucleus	1H
Origin	1H_UBI-VK_18310_15179
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: 987/00001482; Labnumber: 987/00001482218817; VK_ID: VK-015184
Temperature	318 °C