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3-{2-[2-(4-chloro-3,5-dimethylphenoxy)ethoxy]ethyl}-2-(4-methoxyphenyl)-4(3H)-quinazolinone
SpectraBase Compound ID 1nHLEjgHDg0
InChI InChI=1S/C27H27ClN2O4/c1-18-16-22(17-19(2)25(18)28)34-15-14-33-13-12-30-26(20-8-10-21(32-3)11-9-20)29-24-7-5-4-6-23(24)27(30)31/h4-11,16-17H,12-15H2,1-3H3
InChIKey HQAPGMUUIFQFJJ-UHFFFAOYSA-N
Mol Weight 478.98 g/mol
Molecular Formula C27H27ClN2O4
Exact Mass 478.165935 g/mol

1H Nuclear Magnetic Resonance (NMR) Spectrum

1H Nuclear Magnetic Resonance (NMR) Spectrum

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SpectraBase Spectrum ID 3nqfVmCwUmt
Name 3-{2-[2-(4-chloro-3,5-dimethylphenoxy)ethoxy]ethyl}-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/C27H27ClN2O4/c1-18-16-22(17-19(2)25(18)28)34-15-14-33-13-12-30-26(20-8-10-21(32-3)11-9-20)29-24-7-5-4-6-23(24)27(30)31/h4-11,16-17H,12-15H2,1-3H3
InChIKey HQAPGMUUIFQFJJ-UHFFFAOYSA-N
NMR Offset 15.328
NMR Spectrometer Frequency 300.135
Observed nucleus 1H
Origin 1H_SBI_36227_25345
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: D49711; Labnumber: RNOP4-0748; SBI_ID: SBI-025349
Temperature 318 °C