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3-[4-(2-bromo-6-chloro-4-methylphenoxy)butyl]-2-(4-methoxyphenyl)-4(3H)-quinazolinone
SpectraBase Compound ID CDyQayJUCzU
InChI InChI=1S/C26H24BrClN2O3/c1-17-15-21(27)24(22(28)16-17)33-14-6-5-13-30-25(18-9-11-19(32-2)12-10-18)29-23-8-4-3-7-20(23)26(30)31/h3-4,7-12,15-16H,5-6,13-14H2,1-2H3
InChIKey DNSQYKGKXARBAT-UHFFFAOYSA-N
Mol Weight 527.85 g/mol
Molecular Formula C26H24BrClN2O3
Exact Mass 526.065883 g/mol

1H Nuclear Magnetic Resonance (NMR) Spectrum

1H Nuclear Magnetic Resonance (NMR) Spectrum

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SpectraBase Spectrum ID 6wrXvwPXA49
Name 3-[4-(2-bromo-6-chloro-4-methylphenoxy)butyl]-2-(4-methoxyphenyl)-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/C26H24BrClN2O3/c1-17-15-21(27)24(22(28)16-17)33-14-6-5-13-30-25(18-9-11-19(32-2)12-10-18)29-23-8-4-3-7-20(23)26(30)31/h3-4,7-12,15-16H,5-6,13-14H2,1-2H3
InChIKey DNSQYKGKXARBAT-UHFFFAOYSA-N
NMR Offset 15.5012
NMR Spectrometer Frequency 300.135
Observed nucleus 1H
Origin 1H_SBI_36227_21769
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: D55730; Labnumber: RNOP4-0930; SBI_ID: SBI-021773
Temperature 315 °C