4-quinolinecarboxylic acid, 2-[(E)-1-methyl-2-phenylethenyl]-, 2-(4-bromophenyl)-2-oxoethyl ester

SpectraBase Compound ID	AA9B2UVaapO
InChI	InChI=1S/C27H20BrNO3/c1-18(15-19-7-3-2-4-8-19)25-16-23(22-9-5-6-10-24(22)29-25)27(31)32-17-26(30)20-11-13-21(28)14-12-20/h2-16H,17H2,1H3/b18-15+
InChIKey	AWDAGSHLNAEESZ-OBGWFSINSA-N Google Search
Mol Weight	486.37 g/mol
Molecular Formula	C27H20BrNO3
Exact Mass	485.062657 g/mol

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SpectraBase Spectrum ID	JbuFO6Z7Xxz
Name	4-quinolinecarboxylic acid, 2-[(E)-1-methyl-2-phenylethenyl]-, 2-(4-bromophenyl)-2-oxoethyl ester
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/C27H20BrNO3/c1-18(15-19-7-3-2-4-8-19)25-16-23(22-9-5-6-10-24(22)29-25)27(31)32-17-26(30)20-11-13-21(28)14-12-20/h2-16H,17H2,1H3/b18-15+
InChIKey	AWDAGSHLNAEESZ-OBGWFSINSA-N
NMR Offset	18.0068
NMR Spectrometer Frequency	500.134
Observed nucleus	1H
Origin	1H_CB3_9000_824
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/11258855