3-[5-(2-bromo-4,6-dimethylphenoxy)pentyl]-2-(4-chlorophenyl)-4(3H)-quinazolinone

SpectraBase Compound ID	AsFTFHccgaB
InChI	InChI=1S/C27H26BrClN2O2/c1-18-16-19(2)25(23(28)17-18)33-15-7-3-6-14-31-26(20-10-12-21(29)13-11-20)30-24-9-5-4-8-22(24)27(31)32/h4-5,8-13,16-17H,3,6-7,14-15H2,1-2H3
InChIKey	QIHSXROHMAVRTK-UHFFFAOYSA-N Google Search
Mol Weight	525.87 g/mol
Molecular Formula	C27H26BrClN2O2
Exact Mass	524.086619 g/mol

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SpectraBase Spectrum ID	IQGS819YGv
Name	3-[5-(2-bromo-4,6-dimethylphenoxy)pentyl]-2-(4-chlorophenyl)-4(3H)-quinazolinone
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/C27H26BrClN2O2/c1-18-16-19(2)25(23(28)17-18)33-15-7-3-6-14-31-26(20-10-12-21(29)13-11-20)30-24-9-5-4-8-22(24)27(31)32/h4-5,8-13,16-17H,3,6-7,14-15H2,1-2H3
InChIKey	QIHSXROHMAVRTK-UHFFFAOYSA-N
NMR Offset	15.3537
NMR Spectrometer Frequency	300.135
Observed nucleus	1H
Origin	1H_UBI-VK_18310_9032
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: 134080; Labnumber: RNOP3-0205; VK_ID: VK-009036
Temperature	308 °C