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

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5-Pyrimidinecarboxylic acid, 1,2,3,4-tetrahydro-4-(2-methoxyphenyl)-6-methyl-2-oxo-, phenylmethyl ester
SpectraBase Compound ID 8mMYXrkEMLF
InChI InChI=1S/C20H20N2O4/c1-13-17(19(23)26-12-14-8-4-3-5-9-14)18(22-20(24)21-13)15-10-6-7-11-16(15)25-2/h3-11,18H,12H2,1-2H3,(H2,21,22,24)
InChIKey XQXGQMIPNHMCIH-UHFFFAOYSA-N
Mol Weight 352.39 g/mol
Molecular Formula C20H20N2O4
Exact Mass 352.142307 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID 4b7GivDZi6S
Name 5-Pyrimidinecarboxylic acid, 1,2,3,4-tetrahydro-4-(2-methoxyphenyl)-6-methyl-2-oxo-, phenylmethyl ester
Comments Computed using HOSE algorithm
Copyright Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved.
Exact Mass 352.142307128 u
Formula C20H20N2O4
InChI InChI=1S/C20H20N2O4/c1-13-17(19(23)26-12-14-8-4-3-5-9-14)18(22-20(24)21-13)15-10-6-7-11-16(15)25-2/h3-11,18H,12H2,1-2H3,(H2,21,22,24)
InChIKey XQXGQMIPNHMCIH-UHFFFAOYSA-N
Molecular Weight 352.390 g/mol
SMILES N1C(NC(=C(C1C=1C(OC)=CC=CC1)C(OCC=1C=CC=CC1)=O)C)=O