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5-Pyrimidinecarboxylic acid, 1,2,3,4-tetrahydro-6-methyl-2-oxo-4-(4-propoxyphenyl)-, 2-methylpropyl ester
SpectraBase Compound ID HyXGP6mUvvI
InChI InChI=1S/C19H26N2O4/c1-5-10-24-15-8-6-14(7-9-15)17-16(13(4)20-19(23)21-17)18(22)25-11-12(2)3/h6-9,12,17H,5,10-11H2,1-4H3,(H2,20,21,23)
InChIKey SEJOKFUHJGOWOB-UHFFFAOYSA-N
Mol Weight 346.43 g/mol
Molecular Formula C19H26N2O4
Exact Mass 346.189257 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID A4yfB8ikVXa
Name 5-Pyrimidinecarboxylic acid, 1,2,3,4-tetrahydro-6-methyl-2-oxo-4-(4-propoxyphenyl)-, 2-methylpropyl ester
Comments Computed using HOSE algorithm
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Exact Mass 346.189257321 u
Formula C19H26N2O4
InChI InChI=1S/C19H26N2O4/c1-5-10-24-15-8-6-14(7-9-15)17-16(13(4)20-19(23)21-17)18(22)25-11-12(2)3/h6-9,12,17H,5,10-11H2,1-4H3,(H2,20,21,23)
InChIKey SEJOKFUHJGOWOB-UHFFFAOYSA-N
SMILES N1C(NC(C(=C1C)C(OCC(C)C)=O)C1=CC=C(C=C1)OCCC)=O