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3-[6-(4-chloro-3,5-dimethylphenoxy)hexyl]-2-(4-methoxyphenyl)-4(3H)-quinazolinone
SpectraBase Compound ID IzQxH8pKxE7
InChI InChI=1S/C29H31ClN2O3/c1-20-18-24(19-21(2)27(20)30)35-17-9-5-4-8-16-32-28(22-12-14-23(34-3)15-13-22)31-26-11-7-6-10-25(26)29(32)33/h6-7,10-15,18-19H,4-5,8-9,16-17H2,1-3H3
InChIKey HKNGVRQSTDIIDR-UHFFFAOYSA-N
Mol Weight 491.03 g/mol
Molecular Formula C29H31ClN2O3
Exact Mass 490.202321 g/mol

1H Nuclear Magnetic Resonance (NMR) Spectrum

1H Nuclear Magnetic Resonance (NMR) Spectrum

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SpectraBase Spectrum ID 74qlTjxtkf1
Name 3-[6-(4-chloro-3,5-dimethylphenoxy)hexyl]-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/C29H31ClN2O3/c1-20-18-24(19-21(2)27(20)30)35-17-9-5-4-8-16-32-28(22-12-14-23(34-3)15-13-22)31-26-11-7-6-10-25(26)29(32)33/h6-7,10-15,18-19H,4-5,8-9,16-17H2,1-3H3
InChIKey HKNGVRQSTDIIDR-UHFFFAOYSA-N
NMR Offset 15.328
NMR Spectrometer Frequency 300.135
Observed nucleus 1H
Origin 1H_SBI_36227_25346
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: D49712; Labnumber: RNOP4-0749; SBI_ID: SBI-025350
Temperature 318 °C