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3-[4-(4-chloro-3,5-dimethylphenoxy)butyl]-2-(4-methoxyphenyl)-4(3H)-quinazolinone
SpectraBase Compound ID 2r2yFceGvrM
InChI InChI=1S/C27H27ClN2O3/c1-18-16-22(17-19(2)25(18)28)33-15-7-6-14-30-26(20-10-12-21(32-3)13-11-20)29-24-9-5-4-8-23(24)27(30)31/h4-5,8-13,16-17H,6-7,14-15H2,1-3H3
InChIKey FSZMVTFKBMCILE-UHFFFAOYSA-N
Mol Weight 462.98 g/mol
Molecular Formula C27H27ClN2O3
Exact Mass 462.17102 g/mol

1H Nuclear Magnetic Resonance (NMR) Spectrum

1H Nuclear Magnetic Resonance (NMR) Spectrum

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SpectraBase Spectrum ID 2OKHau3w5ow
Name 3-[4-(4-chloro-3,5-dimethylphenoxy)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/C27H27ClN2O3/c1-18-16-22(17-19(2)25(18)28)33-15-7-6-14-30-26(20-10-12-21(32-3)13-11-20)29-24-9-5-4-8-23(24)27(30)31/h4-5,8-13,16-17H,6-7,14-15H2,1-3H3
InChIKey FSZMVTFKBMCILE-UHFFFAOYSA-N
NMR Offset 15.5012
NMR Spectrometer Frequency 300.135
Observed nucleus 1H
Origin 1H_SBI_36227_12205
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: D59809; Labnumber: RNOP4-0978; SBI_ID: SBI-012208
Temperature 315 °C