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6-Ethyl-5-methoxycarbonyl-4-phenyl-3,4-dihydropyrimidin-2(1H)-one
SpectraBase Compound ID CvPSQ3vUpsI
InChI InChI=1S/C14H16N2O3/c1-3-10-11(13(17)19-2)12(16-14(18)15-10)9-7-5-4-6-8-9/h4-8,12H,3H2,1-2H3,(H2,15,16,18)
InChIKey HGWKGAYVNDNPGF-UHFFFAOYSA-N
Mol Weight 260.29 g/mol
Molecular Formula C14H16N2O3
Exact Mass 260.116092 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID 2q5vMvX4qf3
Name 6-Ethyl-5-methoxycarbonyl-4-phenyl-3,4-dihydropyrimidin-2(1H)-one
Comments Computed using HOSE algorithm
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Exact Mass 260.116092380 u
Formula C14H16N2O3
InChI InChI=1S/C14H16N2O3/c1-3-10-11(13(17)19-2)12(16-14(18)15-10)9-7-5-4-6-8-9/h4-8,12H,3H2,1-2H3,(H2,15,16,18)
InChIKey HGWKGAYVNDNPGF-UHFFFAOYSA-N
Molecular Weight 260.293 g/mol
SMILES C1(=C(NC(NC1C=1C=CC=CC1)=O)CC)C(=O)OC