For citations & permissions, please see: Citations & Permissions - Wiley Science Solutions*

*Links on SpectraBase are not permalinks.
2-(4-methoxyphenyl)-3-{2-[2-(2,3,6-trimethylphenoxy)ethoxy]ethyl}-4(3H)-quinazolinone
SpectraBase Compound ID 4CBwxOkDaym
InChI InChI=1S/C28H30N2O4/c1-19-9-10-20(2)26(21(19)3)34-18-17-33-16-15-30-27(22-11-13-23(32-4)14-12-22)29-25-8-6-5-7-24(25)28(30)31/h5-14H,15-18H2,1-4H3
InChIKey ADYHXXVFXAYYHZ-UHFFFAOYSA-N
Mol Weight 458.56 g/mol
Molecular Formula C28H30N2O4
Exact Mass 458.220557 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

Subscribe to view the full spectrum.

The full spectrum can only be viewed using a FREE account.

SpectraBase Spectrum ID LBHqiQ4oGnq
Name 2-(4-Methoxyphenyl)-3-{2-[2-(2,3,6-trimethylphenoxy)ethoxy]ethyl}-4(3H)-quinazolinone
Comments Computed using HOSE algorithm
Copyright Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved.
Exact Mass 458.220557450 u
Formula C28H30N2O4
InChI InChI=1S/C28H30N2O4/c1-19-9-10-20(2)26(21(19)3)34-18-17-33-16-15-30-27(22-11-13-23(32-4)14-12-22)29-25-8-6-5-7-24(25)28(30)31/h5-14H,15-18H2,1-4H3
InChIKey ADYHXXVFXAYYHZ-UHFFFAOYSA-N
Molecular Weight 458.558 g/mol
SMILES C=1C=CC=2C(N(C(=NC2C1)C=1C=CC(=CC1)OC)CCOCCOC=1C(=C(C)C=CC1C)C)=O