3-[5-(4-tert-butylphenoxy)pentyl]-2-(4-chlorophenyl)-4(3H)-quinazolinone

SpectraBase Compound ID	DWBJOQ2Qova
InChI	InChI=1S/C29H31ClN2O2/c1-29(2,3)22-13-17-24(18-14-22)34-20-8-4-7-19-32-27(21-11-15-23(30)16-12-21)31-26-10-6-5-9-25(26)28(32)33/h5-6,9-18H,4,7-8,19-20H2,1-3H3
InChIKey	JBKSATNWUSGHAL-UHFFFAOYSA-N Google Search
Mol Weight	475.03 g/mol
Molecular Formula	C29H31ClN2O2
Exact Mass	474.207406 g/mol

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SpectraBase Spectrum ID	1yBocLyjBVM
Name	3-[5-(4-tert-butylphenoxy)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/C29H31ClN2O2/c1-29(2,3)22-13-17-24(18-14-22)34-20-8-4-7-19-32-27(21-11-15-23(30)16-12-21)31-26-10-6-5-9-25(26)28(32)33/h5-6,9-18H,4,7-8,19-20H2,1-3H3
InChIKey	JBKSATNWUSGHAL-UHFFFAOYSA-N
NMR Offset	15.3537
NMR Spectrometer Frequency	300.135
Observed nucleus	1H
Origin	1H_UBI-VK_18310_9029
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: 134072; Labnumber: RNOP3-0194; VK_ID: VK-009033
Temperature	308 °C