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3-[3-(2-ethylphenoxy)propyl]-2-(4-methoxyphenyl)-4(3H)-quinazolinone

View entire compound with spectra: 2 NMR

3-[3-(2-ethylphenoxy)propyl]-2-(4-methoxyphenyl)-4(3H)-quinazolinone
SpectraBase Compound ID 4FrFUrE9b6F
InChI InChI=1S/C26H26N2O3/c1-3-19-9-4-7-12-24(19)31-18-8-17-28-25(20-13-15-21(30-2)16-14-20)27-23-11-6-5-10-22(23)26(28)29/h4-7,9-16H,3,8,17-18H2,1-2H3
InChIKey LPHCAORFKKFNEF-UHFFFAOYSA-N
Mol Weight 414.51 g/mol
Molecular Formula C26H26N2O3
Exact Mass 414.194343 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID DN1HjuMnaBl
Name 3-[3-(2-Ethylphenoxy)propyl]-2-(4-methoxyphenyl)-4(3H)-quinazolinone
Comments Computed using HOSE algorithm
Copyright Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved.
Exact Mass 414.194342702 u
Formula C26H26N2O3
InChI InChI=1S/C26H26N2O3/c1-3-19-9-4-7-12-24(19)31-18-8-17-28-25(20-13-15-21(30-2)16-14-20)27-23-11-6-5-10-22(23)26(28)29/h4-7,9-16H,3,8,17-18H2,1-2H3
InChIKey LPHCAORFKKFNEF-UHFFFAOYSA-N
Molecular Weight 414.505 g/mol
SMILES C=1C=CC(OCCCN2C(=NC3=C(C2=O)C=CC=C3)C=2C=CC(=CC2)OC)=C(CC)C1