Ethyl 6-methyl-2-oxo-4-(4-oxo-4H-chromen-3-yl)-1,2,3,4-tetrahydropyrimidine-5-carboxylate

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Systematic / IUPAC Name: Ethyl 6-methyl-2-oxo-4-(4-oxo-4H-chromen-3-yl)-1,2,3,4-tetrahydro-5-pyrimidinecarboxylate

ID: Reference6453

Other Names: Ethyl 6-methyl-2-oxo-4-(4-oxochromen-3-yl)-3,4-dihydro-1H-pyrimidine-5-carboxylate;
5-Pyrimidinecarboxylic acid, 1,2,3,4-tetrahydro-6-methyl-2-oxo-4-(4-oxo-4H-1-benzopyran-3-yl)-, ethyl ester

Formula: C17H16N2O5

Spectral Data

Ethyl 6-methyl-2-oxo-4-(4-oxo-4H-chromen-3-yl)-1,2,3,4-tetrahydropyrimidine-5-carboxylate mass spectral data can be found in a separate interface. The data are manually curated and of the highest quality.

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Available MS Data

Used Instruments Q Exactive Orbitrap
No. of Spectral Trees 1
No. of Spectra 117
Tandem Spectra MS1, MS2
Ionization Methods ESI
Analyzers FT
Last Modification 3/9/2017 12:03:01 PM
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Identificators

InChI InChI=1S/C17H16N2O5/c1-3-23-16(21)13-9(2)18-17(22)19-14(13)11-8-24-12-7-5-4-6-10(12)15(11)20/h4-8,14H,3H2,1-2H3,(H2,18,19,22)
InChI Key QXMMJHRFDSEGBP-UHFFFAOYSA-N
Canonical SMILES CCOC(=O)C1=C(NC(=O)NC1C2=COC3=CC=CC=C3C2=O)C
CAS
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Other Names Ethyl 6-methyl-2-oxo-4-(4-oxochromen-3-yl)-3,4-dihydro-1H-pyrimidine-5-carboxylate;
5-Pyrimidinecarboxylic acid, 1,2,3,4-tetrahydro-6-methyl-2-oxo-4-(4-oxo-4H-1-benzopyran-3-yl)-, ethyl ester

In Other Databases

ChemSpider 2008175
ChEMBL CHEMBL1771028
PubChem 2726105