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

*Links on SpectraBase are not permalinks.

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

View entire compound with spectra: 2 NMR

5-Pyrimidinecarboxylic acid, 1,2,3,4-tetrahydro-4-(4-methoxyphenyl)-6-methyl-2-oxo-, cyclopentyl ester
SpectraBase Compound ID 7WggfYBjta4
InChI InChI=1S/C18H22N2O4/c1-11-15(17(21)24-14-5-3-4-6-14)16(20-18(22)19-11)12-7-9-13(23-2)10-8-12/h7-10,14,16H,3-6H2,1-2H3,(H2,19,20,22)
InChIKey VUHFWQBMGIAXIQ-UHFFFAOYSA-N
Mol Weight 330.38 g/mol
Molecular Formula C18H22N2O4
Exact Mass 330.157957 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

View the Full Spectrum for FREE!

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

SpectraBase Spectrum ID HoKl8eRpxBu
Name 5-Pyrimidinecarboxylic acid, 1,2,3,4-tetrahydro-4-(4-methoxyphenyl)-6-methyl-2-oxo-, cyclopentyl ester
Comments Computed using HOSE algorithm
Copyright Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved.
Exact Mass 330.157957192 u
Formula C18H22N2O4
InChI InChI=1S/C18H22N2O4/c1-11-15(17(21)24-14-5-3-4-6-14)16(20-18(22)19-11)12-7-9-13(23-2)10-8-12/h7-10,14,16H,3-6H2,1-2H3,(H2,19,20,22)
InChIKey VUHFWQBMGIAXIQ-UHFFFAOYSA-N
SMILES N1C(NC(C(=C1C)C(OC1CCCC1)=O)C1=CC=C(C=C1)OC)=O