For citations & permissions, please see: Citations & Permissions - Wiley Science Solutions*

*Links on SpectraBase are not permalinks.

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

View entire compound with spectra: 2 NMR

5-Pyrimidinecarboxylic acid, 4-(3-chlorophenyl)-1,2,3,4-tetrahydro-6-methyl-2-oxo-, 1-methylethyl ester
SpectraBase Compound ID 6izzpIXHarV
InChI InChI=1S/C15H17ClN2O3/c1-8(2)21-14(19)12-9(3)17-15(20)18-13(12)10-5-4-6-11(16)7-10/h4-8,13H,1-3H3,(H2,17,18,20)
InChIKey PLNXIQZVIUFBQR-UHFFFAOYSA-N
Mol Weight 308.76 g/mol
Molecular Formula C15H17ClN2O3
Exact Mass 308.09277 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

Subscribe to view the full spectrum.

The full spectrum can only be viewed using a FREE account.

SpectraBase Spectrum ID 4UaLaByZsaG
Name 5-Pyrimidinecarboxylic acid, 4-(3-chlorophenyl)-1,2,3,4-tetrahydro-6-methyl-2-oxo-, 1-methylethyl ester
Comments Computed using HOSE algorithm
Copyright Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved.
Exact Mass 308.092770112 u
Formula C15H17ClN2O3
InChI InChI=1S/C15H17ClN2O3/c1-8(2)21-14(19)12-9(3)17-15(20)18-13(12)10-5-4-6-11(16)7-10/h4-8,13H,1-3H3,(H2,17,18,20)
InChIKey PLNXIQZVIUFBQR-UHFFFAOYSA-N
Molecular Weight 308.765 g/mol
SMILES N1C(NC(=C(C1C=1C=C(Cl)C=CC1)C(OC(C)C)=O)C)=O