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3-[4-(4-fluorophenoxy)butyl]-2-(4-methoxyphenyl)-4(3H)-quinazolinone

View entire compound with spectra: 2 NMR

3-[4-(4-fluorophenoxy)butyl]-2-(4-methoxyphenyl)-4(3H)-quinazolinone
SpectraBase Compound ID HRnGFfIji8E
InChI InChI=1S/C25H23FN2O3/c1-30-20-12-8-18(9-13-20)24-27-23-7-3-2-6-22(23)25(29)28(24)16-4-5-17-31-21-14-10-19(26)11-15-21/h2-3,6-15H,4-5,16-17H2,1H3
InChIKey GPJAQBADUAXNAB-UHFFFAOYSA-N
Mol Weight 418.47 g/mol
Molecular Formula C25H23FN2O3
Exact Mass 418.169271 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID 7cAzvkACPsE
Name 3-[4-(4-Fluorophenoxy)butyl]-2-(4-methoxyphenyl)-4(3H)-quinazolinone
Comments Computed using HOSE algorithm
Copyright Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved.
Exact Mass 418.169270769 u
Formula C25H23FN2O3
InChI InChI=1S/C25H23FN2O3/c1-30-20-12-8-18(9-13-20)24-27-23-7-3-2-6-22(23)25(29)28(24)16-4-5-17-31-21-14-10-19(26)11-15-21/h2-3,6-15H,4-5,16-17H2,1H3
InChIKey GPJAQBADUAXNAB-UHFFFAOYSA-N
Molecular Weight 418.468 g/mol
SMILES C=1C=CC=2C(N(C(=NC2C1)C=1C=CC(=CC1)OC)CCCCOC1=CC=C(C=C1)F)=O