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

View entire compound with spectra: 2 NMR

5-Pyrimidinecarboxylic acid, 4-(4-fluorophenyl)-1,2,3,4-tetrahydro-6-methyl-2-oxo-, phenylmethyl ester
SpectraBase Compound ID 4KFa3vO7Onp
InChI InChI=1S/C19H17FN2O3/c1-12-16(18(23)25-11-13-5-3-2-4-6-13)17(22-19(24)21-12)14-7-9-15(20)10-8-14/h2-10,17H,11H2,1H3,(H2,21,22,24)
InChIKey AJVDIWGTTGZDPF-UHFFFAOYSA-N
Mol Weight 340.35 g/mol
Molecular Formula C19H17FN2O3
Exact Mass 340.122321 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID KY6FwWeqqtO
Name 5-Pyrimidinecarboxylic acid, 4-(4-fluorophenyl)-1,2,3,4-tetrahydro-6-methyl-2-oxo-, phenylmethyl ester
Comments Computed using HOSE algorithm
Copyright Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved.
Exact Mass 340.122320575 u
Formula C19H17FN2O3
InChI InChI=1S/C19H17FN2O3/c1-12-16(18(23)25-11-13-5-3-2-4-6-13)17(22-19(24)21-12)14-7-9-15(20)10-8-14/h2-10,17H,11H2,1H3,(H2,21,22,24)
InChIKey AJVDIWGTTGZDPF-UHFFFAOYSA-N
Molecular Weight 340.354 g/mol
SMILES N1C(NC(C(=C1C)C(OCC=1C=CC=CC1)=O)C1=CC=C(C=C1)F)=O