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3-[6-(mesityloxy)hexyl]-2-(4-methoxyphenyl)-4(3H)-quinazolinone

View entire compound with spectra: 2 NMR

3-[6-(mesityloxy)hexyl]-2-(4-methoxyphenyl)-4(3H)-quinazolinone
SpectraBase Compound ID 55EffG3P427
InChI InChI=1S/C30H34N2O3/c1-21-19-22(2)28(23(3)20-21)35-18-10-6-5-9-17-32-29(24-13-15-25(34-4)16-14-24)31-27-12-8-7-11-26(27)30(32)33/h7-8,11-16,19-20H,5-6,9-10,17-18H2,1-4H3
InChIKey OKYBXHQWKVQTJE-UHFFFAOYSA-N
Mol Weight 470.6 g/mol
Molecular Formula C30H34N2O3
Exact Mass 470.256943 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID 4yUdtIZMD9e
Name 3-[6-(Mesityloxy)hexyl]-2-(4-methoxyphenyl)-4(3H)-quinazolinone
Comments Computed using HOSE algorithm
Copyright Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved.
Exact Mass 470.256942960 u
Formula C30H34N2O3
InChI InChI=1S/C30H34N2O3/c1-21-19-22(2)28(23(3)20-21)35-18-10-6-5-9-17-32-29(24-13-15-25(34-4)16-14-24)31-27-12-8-7-11-26(27)30(32)33/h7-8,11-16,19-20H,5-6,9-10,17-18H2,1-4H3
InChIKey OKYBXHQWKVQTJE-UHFFFAOYSA-N
Molecular Weight 470.613 g/mol
SMILES C=1C=CC=2C(N(C(=NC2C1)C=1C=CC(=CC1)OC)CCCCCCOC=1C(=CC(=CC1C)C)C)=O