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5-Pyrimidinecarboxylic acid, 4-(4-ethylphenyl)-1,2,3,4-tetrahydro-6-methyl-2-oxo-, 2-methylpropyl ester

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5-Pyrimidinecarboxylic acid, 4-(4-ethylphenyl)-1,2,3,4-tetrahydro-6-methyl-2-oxo-, 2-methylpropyl ester
SpectraBase Compound ID HHb1JmKcjRZ
InChI InChI=1S/C18H24N2O3/c1-5-13-6-8-14(9-7-13)16-15(12(4)19-18(22)20-16)17(21)23-10-11(2)3/h6-9,11,16H,5,10H2,1-4H3,(H2,19,20,22)
InChIKey BZNOHJFTMOEZPM-UHFFFAOYSA-N
Mol Weight 316.4 g/mol
Molecular Formula C18H24N2O3
Exact Mass 316.178693 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID JBQpjeDdpEq
Name 5-Pyrimidinecarboxylic acid, 4-(4-ethylphenyl)-1,2,3,4-tetrahydro-6-methyl-2-oxo-, 2-methylpropyl ester
Comments Computed using HOSE algorithm
Copyright Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved.
Exact Mass 316.178692638 u
Formula C18H24N2O3
InChI InChI=1S/C18H24N2O3/c1-5-13-6-8-14(9-7-13)16-15(12(4)19-18(22)20-16)17(21)23-10-11(2)3/h6-9,11,16H,5,10H2,1-4H3,(H2,19,20,22)
InChIKey BZNOHJFTMOEZPM-UHFFFAOYSA-N
Molecular Weight 316.401 g/mol
SMILES N1C(NC(C(=C1C)C(OCC(C)C)=O)C=1C=CC(=CC1)CC)=O