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3-[6-(2-chloro-6-methylphenoxy)hexyl]-2-(4-methoxyphenyl)-4(3H)-quinazolinone
SpectraBase Compound ID KqhCtpbKcCT
InChI InChI=1S/C28H29ClN2O3/c1-20-10-9-12-24(29)26(20)34-19-8-4-3-7-18-31-27(21-14-16-22(33-2)17-15-21)30-25-13-6-5-11-23(25)28(31)32/h5-6,9-17H,3-4,7-8,18-19H2,1-2H3
InChIKey XZNPWGSJHRZVHL-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 AZKUNT35WRc
Name 3-[6-(2-chloro-6-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/c1-20-10-9-12-24(29)26(20)34-19-8-4-3-7-18-31-27(21-14-16-22(33-2)17-15-21)30-25-13-6-5-11-23(25)28(31)32/h5-6,9-17H,3-4,7-8,18-19H2,1-2H3
InChIKey XZNPWGSJHRZVHL-UHFFFAOYSA-N
NMR Offset 15.328
NMR Spectrometer Frequency 300.135
Observed nucleus 1H
Origin 1H_SBI_36227_25340
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: D49706; Labnumber: RNOP4-0701; SBI_ID: SBI-025344
Temperature 318 °C