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3-[6-(4-chloro-3-ethylphenoxy)hexyl]-2-(4-methoxyphenyl)-4(3H)-quinazolinone
SpectraBase Compound ID 5hsGI1hF344
InChI InChI=1S/C29H31ClN2O3/c1-3-21-20-24(16-17-26(21)30)35-19-9-5-4-8-18-32-28(22-12-14-23(34-2)15-13-22)31-27-11-7-6-10-25(27)29(32)33/h6-7,10-17,20H,3-5,8-9,18-19H2,1-2H3
InChIKey YOZXLGBWKFJZRV-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 Ku6LtMnqvA3
Name 3-[6-(4-chloro-3-ethylphenoxy)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/c1-3-21-20-24(16-17-26(21)30)35-19-9-5-4-8-18-32-28(22-12-14-23(34-2)15-13-22)31-27-11-7-6-10-25(27)29(32)33/h6-7,10-17,20H,3-5,8-9,18-19H2,1-2H3
InChIKey YOZXLGBWKFJZRV-UHFFFAOYSA-N
NMR Offset 15.328
NMR Spectrometer Frequency 300.135
Observed nucleus 1H
Origin 1H_SBI_36227_25351
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: D49717; Labnumber: RNOP4-0756; SBI_ID: SBI-025355
Temperature 318 °C