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2-Phenoxyethyl 4-[4-(diethylamino)phenyl]-6-methyl-2-oxo-1,2,3,4-tetrahydro-5-pyrimidinecarboxylate
SpectraBase Compound ID 80ElAfBp5lT
InChI InChI=1S/C24H29N3O4/c1-4-27(5-2)19-13-11-18(12-14-19)22-21(17(3)25-24(29)26-22)23(28)31-16-15-30-20-9-7-6-8-10-20/h6-14,22H,4-5,15-16H2,1-3H3,(H2,25,26,29)
InChIKey KVXCJDBYPIEREP-UHFFFAOYSA-N
Mol Weight 423.51 g/mol
Molecular Formula C24H29N3O4
Exact Mass 423.215806 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID Bj87JayZHrF
Name 2-Phenoxyethyl 4-[4-(diethylamino)phenyl]-6-methyl-2-oxo-1,2,3,4-tetrahydro-5-pyrimidinecarboxylate
Comments Computed using HOSE algorithm
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Exact Mass 423.215806422 u
Formula C24H29N3O4
InChI InChI=1S/C24H29N3O4/c1-4-27(5-2)19-13-11-18(12-14-19)22-21(17(3)25-24(29)26-22)23(28)31-16-15-30-20-9-7-6-8-10-20/h6-14,22H,4-5,15-16H2,1-3H3,(H2,25,26,29)
InChIKey KVXCJDBYPIEREP-UHFFFAOYSA-N
Molecular Weight 423.513 g/mol
SMILES N1C(NC(C(=C1C)C(=O)OCCOC=1C=CC=CC1)C1=CC=C(N(CC)CC)C=C1)=O