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

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5-Pyrimidinecarboxylic acid, 4-(3-chlorophenyl)-1,2,3,4-tetrahydro-6-methyl-2-oxo-, 2-phenoxyethyl ester
SpectraBase Compound ID 6Joi1Uktjm9
InChI InChI=1S/C20H19ClN2O4/c1-13-17(19(24)27-11-10-26-16-8-3-2-4-9-16)18(23-20(25)22-13)14-6-5-7-15(21)12-14/h2-9,12,18H,10-11H2,1H3,(H2,22,23,25)
InChIKey UGUWYTIMDBNHJH-UHFFFAOYSA-N
Mol Weight 386.84 g/mol
Molecular Formula C20H19ClN2O4
Exact Mass 386.103335 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID CDlH2nHP5Yq
Name 5-Pyrimidinecarboxylic acid, 4-(3-chlorophenyl)-1,2,3,4-tetrahydro-6-methyl-2-oxo-, 2-phenoxyethyl ester
Comments Computed using HOSE algorithm
Copyright Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved.
Exact Mass 386.103334796 u
Formula C20H19ClN2O4
InChI InChI=1S/C20H19ClN2O4/c1-13-17(19(24)27-11-10-26-16-8-3-2-4-9-16)18(23-20(25)22-13)14-6-5-7-15(21)12-14/h2-9,12,18H,10-11H2,1H3,(H2,22,23,25)
InChIKey UGUWYTIMDBNHJH-UHFFFAOYSA-N
Molecular Weight 386.835 g/mol
SMILES N1C(NC(=C(C1C=1C=C(Cl)C=CC1)C(=O)OCCOC1=CC=CC=C1)C)=O