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3-[4-(2-chloro-4-methylphenoxy)butyl]-2-(4-chlorophenyl)-4(3H)-quinazolinone
SpectraBase Compound ID FKxBnS4wC9b
InChI InChI=1S/C25H22Cl2N2O2/c1-17-8-13-23(21(27)16-17)31-15-5-4-14-29-24(18-9-11-19(26)12-10-18)28-22-7-3-2-6-20(22)25(29)30/h2-3,6-13,16H,4-5,14-15H2,1H3
InChIKey HPRDJTGCNLEZKK-UHFFFAOYSA-N
Mol Weight 453.37 g/mol
Molecular Formula C25H22Cl2N2O2
Exact Mass 452.105833 g/mol

1H Nuclear Magnetic Resonance (NMR) Spectrum

1H Nuclear Magnetic Resonance (NMR) Spectrum

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SpectraBase Spectrum ID 8G3QoyVeNG3
Name 3-[4-(2-chloro-4-methylphenoxy)butyl]-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/C25H22Cl2N2O2/c1-17-8-13-23(21(27)16-17)31-15-5-4-14-29-24(18-9-11-19(26)12-10-18)28-22-7-3-2-6-20(22)25(29)30/h2-3,6-13,16H,4-5,14-15H2,1H3
InChIKey HPRDJTGCNLEZKK-UHFFFAOYSA-N
NMR Offset 18.0059
NMR Spectrometer Frequency 300.135
Observed nucleus 1H
Origin 1H_SBI_36227_6192
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: D13653; Labnumber: RNOP3-0127-1; SBI_ID: SBI-006195
Temperature 308 °C