1-piperazinebutanoic acid, 4-[6-bromo-4-(2-chlorophenyl)-2-quinazolinyl]-gamma-oxo-

SpectraBase Compound ID	I5og8j4bmf
InChI	InChI=1S/C22H20BrClN4O3/c23-14-5-6-18-16(13-14)21(15-3-1-2-4-17(15)24)26-22(25-18)28-11-9-27(10-12-28)19(29)7-8-20(30)31/h1-6,13H,7-12H2,(H,30,31)
InChIKey	CJWRZEGXLDKDGH-UHFFFAOYSA-N Google Search
Mol Weight	503.78 g/mol
Molecular Formula	C22H20BrClN4O3
Exact Mass	502.040731 g/mol

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SpectraBase Spectrum ID	439DE7ehWL3
Name	1-piperazinebutanoic acid, 4-[6-bromo-4-(2-chlorophenyl)-2-quinazolinyl]-gamma-oxo-
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/C22H20BrClN4O3/c23-14-5-6-18-16(13-14)21(15-3-1-2-4-17(15)24)26-22(25-18)28-11-9-27(10-12-28)19(29)7-8-20(30)31/h1-6,13H,7-12H2,(H,30,31)
InChIKey	CJWRZEGXLDKDGH-UHFFFAOYSA-N
NMR Offset	18.0068
NMR Spectrometer Frequency	500.134
Observed nucleus	1H
Origin	1H_CB_8313_8195
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/11218289