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3-{2-[2-(4-tert-butyl-2-methylphenoxy)ethoxy]ethyl}-2-(4-methoxyphenyl)-4(3H)-quinazolinone

View entire compound with spectra: 2 NMR

3-{2-[2-(4-tert-butyl-2-methylphenoxy)ethoxy]ethyl}-2-(4-methoxyphenyl)-4(3H)-quinazolinone
SpectraBase Compound ID AWizu48Axmj
InChI InChI=1S/C30H34N2O4/c1-21-20-23(30(2,3)4)12-15-27(21)36-19-18-35-17-16-32-28(22-10-13-24(34-5)14-11-22)31-26-9-7-6-8-25(26)29(32)33/h6-15,20H,16-19H2,1-5H3
InChIKey VXYQYUVWLIQOTJ-UHFFFAOYSA-N
Mol Weight 486.6 g/mol
Molecular Formula C30H34N2O4
Exact Mass 486.251858 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID ApHO4OJhAbj
Name 3-{2-[2-(4-Tert-butyl-2-methylphenoxy)ethoxy]ethyl}-2-(4-methoxyphenyl)-4(3H)-quinazolinone
Comments Computed using HOSE algorithm
Copyright Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved.
Exact Mass 486.251857579 u
Formula C30H34N2O4
InChI InChI=1S/C30H34N2O4/c1-21-20-23(30(2,3)4)12-15-27(21)36-19-18-35-17-16-32-28(22-10-13-24(34-5)14-11-22)31-26-9-7-6-8-25(26)29(32)33/h6-15,20H,16-19H2,1-5H3
InChIKey VXYQYUVWLIQOTJ-UHFFFAOYSA-N
Molecular Weight 486.612 g/mol
SMILES C=1C=CC=2C(N(C(=NC2C1)C1=CC=C(C=C1)OC)CCOCCOC=1C(=CC(=CC1)C(C)(C)C)C)=O