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2-(4-chlorophenyl)-3-[5-(2,6-dimethylphenoxy)pentyl]-4(3H)-quinazolinone
SpectraBase Compound ID JaQk0LFccV0
InChI InChI=1S/C27H27ClN2O2/c1-19-9-8-10-20(2)25(19)32-18-7-3-6-17-30-26(21-13-15-22(28)16-14-21)29-24-12-5-4-11-23(24)27(30)31/h4-5,8-16H,3,6-7,17-18H2,1-2H3
InChIKey WLKKAINIYNCFNL-UHFFFAOYSA-N
Mol Weight 446.98 g/mol
Molecular Formula C27H27ClN2O2
Exact Mass 446.176106 g/mol

1H Nuclear Magnetic Resonance (NMR) Spectrum

1H Nuclear Magnetic Resonance (NMR) Spectrum

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SpectraBase Spectrum ID 27BkP2TJJtO
Name 2-(4-chlorophenyl)-3-[5-(2,6-dimethylphenoxy)pentyl]-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/C27H27ClN2O2/c1-19-9-8-10-20(2)25(19)32-18-7-3-6-17-30-26(21-13-15-22(28)16-14-21)29-24-12-5-4-11-23(24)27(30)31/h4-5,8-16H,3,6-7,17-18H2,1-2H3
InChIKey WLKKAINIYNCFNL-UHFFFAOYSA-N
NMR Offset 15.3537
NMR Spectrometer Frequency 300.135
Observed nucleus 1H
Origin 1H_UBI-VK_18310_9031
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: 134077; Labnumber: RNOP3-0201; VK_ID: VK-009035
Temperature 308 °C