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5-acetyl-4-[4-(allyloxy)-3-ethoxyphenyl]-6-methyl-3,4-dihydro-2(1H)-pyrimidinone

View entire compound with spectra: 2 NMR

5-acetyl-4-[4-(allyloxy)-3-ethoxyphenyl]-6-methyl-3,4-dihydro-2(1H)-pyrimidinone
SpectraBase Compound ID BJORnMUEiEC
InChI InChI=1S/C18H22N2O4/c1-5-9-24-14-8-7-13(10-15(14)23-6-2)17-16(12(4)21)11(3)19-18(22)20-17/h5,7-8,10,17H,1,6,9H2,2-4H3,(H2,19,20,22)
InChIKey KSCWSBDQBJXPGY-UHFFFAOYSA-N
Mol Weight 330.38 g/mol
Molecular Formula C18H22N2O4
Exact Mass 330.157957 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID N0AVIOABMN
Name 5-Acetyl-4-[4-(allyloxy)-3-ethoxyphenyl]-6-methyl-3,4-dihydro-2(1H)-pyrimidinone
Comments Computed using HOSE algorithm
Copyright Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved.
Exact Mass 330.157957192 u
Formula C18H22N2O4
InChI InChI=1S/C18H22N2O4/c1-5-9-24-14-8-7-13(10-15(14)23-6-2)17-16(12(4)21)11(3)19-18(22)20-17/h5,7-8,10,17H,1,6,9H2,2-4H3,(H2,19,20,22)
InChIKey KSCWSBDQBJXPGY-UHFFFAOYSA-N
SMILES N1C(NC(=C(C1C1=CC(=C(C=C1)OCC=C)OCC)C(=O)C)C)=O