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3-[6-(4-chloro-3-methylphenoxy)hexyl]-2-(4-methoxyphenyl)-4(3H)-quinazolinone
SpectraBase Compound ID K8hbvPtoEG9
InChI InChI=1S/C28H29ClN2O3/c1-20-19-23(15-16-25(20)29)34-18-8-4-3-7-17-31-27(21-11-13-22(33-2)14-12-21)30-26-10-6-5-9-24(26)28(31)32/h5-6,9-16,19H,3-4,7-8,17-18H2,1-2H3
InChIKey SWAPNIQALLRZIO-UHFFFAOYSA-N
Mol Weight 477.0 g/mol
Molecular Formula C28H29ClN2O3
Exact Mass 476.18667 g/mol

1H Nuclear Magnetic Resonance (NMR) Spectrum

1H Nuclear Magnetic Resonance (NMR) Spectrum

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SpectraBase Spectrum ID 7J3WfumQpFO
Name 3-[6-(4-chloro-3-methylphenoxy)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/C28H29ClN2O3/c1-20-19-23(15-16-25(20)29)34-18-8-4-3-7-17-31-27(21-11-13-22(33-2)14-12-21)30-26-10-6-5-9-24(26)28(31)32/h5-6,9-16,19H,3-4,7-8,17-18H2,1-2H3
InChIKey SWAPNIQALLRZIO-UHFFFAOYSA-N
NMR Offset 15.328
NMR Spectrometer Frequency 300.135
Observed nucleus 1H
Origin 1H_SBI_36227_25349
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: D49715; Labnumber: RNOP4-0752; SBI_ID: SBI-025353
Temperature 318 °C