4-benzoyl-1-[2-(3-nitroanilino)-2-oxoethyl]pyridinium bromide

SpectraBase Compound ID	3SNOjmvS7ej
InChI	InChI=1S/C20H15N3O4.BrH/c24-19(21-17-7-4-8-18(13-17)23(26)27)14-22-11-9-16(10-12-22)20(25)15-5-2-1-3-6-15;/h1-13H,14H2;1H
InChIKey	JZKILRHJBZBCBV-UHFFFAOYSA-N Google Search
Mol Weight	442.27 g/mol
Molecular Formula	C20H16BrN3O4
Exact Mass	441.032419 g/mol

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SpectraBase Spectrum ID	HfVFxXVHtN1
Name	4-benzoyl-1-[2-(3-nitroanilino)-2-oxoethyl]pyridinium 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/C20H15N3O4.BrH/c24-19(21-17-7-4-8-18(13-17)23(26)27)14-22-11-9-16(10-12-22)20(25)15-5-2-1-3-6-15;/h1-13H,14H2;1H
InChIKey	JZKILRHJBZBCBV-UHFFFAOYSA-N
NMR Offset	15.328
NMR Spectrometer Frequency	300.135
Observed nucleus	1H
Origin	1H_UBI-VK_18310_9287
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: N19911; Labnumber: UD15-116; VK_ID: VK-009291
Temperature	318 °C