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3-[6-(4-chloro-2-methylphenoxy)hexyl]-2-(4-methoxyphenyl)-4(3H)-quinazolinone
SpectraBase Compound ID KD1e0IF7KtR
InChI InChI=1S/C28H29ClN2O3/c1-20-19-22(29)13-16-26(20)34-18-8-4-3-7-17-31-27(21-11-14-23(33-2)15-12-21)30-25-10-6-5-9-24(25)28(31)32/h5-6,9-16,19H,3-4,7-8,17-18H2,1-2H3
InChIKey UJPCKQRWFOXQPT-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 JspHwGWYzUF
Name 3-[6-(4-chloro-2-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/c1-20-19-22(29)13-16-26(20)34-18-8-4-3-7-17-31-27(21-11-14-23(33-2)15-12-21)30-25-10-6-5-9-24(25)28(31)32/h5-6,9-16,19H,3-4,7-8,17-18H2,1-2H3
InChIKey UJPCKQRWFOXQPT-UHFFFAOYSA-N
NMR Offset 15.328
NMR Spectrometer Frequency 300.135
Observed nucleus 1H
Origin 1H_SBI_36227_25343
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: D49709; Labnumber: RNOP4-0744; SBI_ID: SBI-025347
Temperature 318 °C