2-(4-chlorophenyl)-3-[5-(2,3,5-trimethylphenoxy)pentyl]-4(3H)-quinazolinone

SpectraBase Compound ID	6FowXbo596P
InChI	InChI=1S/C28H29ClN2O2/c1-19-17-20(2)21(3)26(18-19)33-16-8-4-7-15-31-27(22-11-13-23(29)14-12-22)30-25-10-6-5-9-24(25)28(31)32/h5-6,9-14,17-18H,4,7-8,15-16H2,1-3H3
InChIKey	MGTOKGJLCSHYTJ-UHFFFAOYSA-N Google Search
Mol Weight	461.01 g/mol
Molecular Formula	C28H29ClN2O2
Exact Mass	460.191756 g/mol

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SpectraBase Spectrum ID	GCP6FdVL8ID
Name	2-(4-chlorophenyl)-3-[5-(2,3,5-trimethylphenoxy)pentyl]-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/C28H29ClN2O2/c1-19-17-20(2)21(3)26(18-19)33-16-8-4-7-15-31-27(22-11-13-23(29)14-12-22)30-25-10-6-5-9-24(25)28(31)32/h5-6,9-14,17-18H,4,7-8,15-16H2,1-3H3
InChIKey	MGTOKGJLCSHYTJ-UHFFFAOYSA-N
NMR Offset	15.3537
NMR Spectrometer Frequency	300.135
Observed nucleus	1H
Origin	1H_UBI-VK_18310_9030
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: 134074; Labnumber: RNOP3-0198; VK_ID: VK-009034
Temperature	308 °C