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

View entire compound with spectra: 2 NMR

3-[4-(2-methoxy-4-methylphenoxy)butyl]-2-(4-methoxyphenyl)-4(3H)-quinazolinone
SpectraBase Compound ID 7WdkENWe7cQ
InChI InChI=1S/C27H28N2O4/c1-19-10-15-24(25(18-19)32-3)33-17-7-6-16-29-26(20-11-13-21(31-2)14-12-20)28-23-9-5-4-8-22(23)27(29)30/h4-5,8-15,18H,6-7,16-17H2,1-3H3
InChIKey QGTKQVVCTSUJMK-UHFFFAOYSA-N
Mol Weight 444.53 g/mol
Molecular Formula C27H28N2O4
Exact Mass 444.204907 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID JuV8aUz8EQL
Name 3-[4-(2-Methoxy-4-methylphenoxy)butyl]-2-(4-methoxyphenyl)-4(3H)-quinazolinone
Comments Computed using HOSE algorithm
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Exact Mass 444.204907386 u
Formula C27H28N2O4
InChI InChI=1S/C27H28N2O4/c1-19-10-15-24(25(18-19)32-3)33-17-7-6-16-29-26(20-11-13-21(31-2)14-12-20)28-23-9-5-4-8-22(23)27(29)30/h4-5,8-15,18H,6-7,16-17H2,1-3H3
InChIKey QGTKQVVCTSUJMK-UHFFFAOYSA-N
Molecular Weight 444.531 g/mol
SMILES C=1C=CC=2C(N(C(=NC2C1)C1=CC=C(C=C1)OC)CCCCOC=1C(=CC(=CC1)C)OC)=O