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2,2,2-Trifluoroethyl 4-(4-ethoxyphenyl)-6-methyl-2-oxo-1,2,3,4-tetrahydro-5-pyrimidinecarboxylate
SpectraBase Compound ID BtDvjiwRRxP
InChI InChI=1S/C16H17F3N2O4/c1-3-24-11-6-4-10(5-7-11)13-12(9(2)20-15(23)21-13)14(22)25-8-16(17,18)19/h4-7,13H,3,8H2,1-2H3,(H2,20,21,23)
InChIKey KOLLMAPRBSKZIK-UHFFFAOYSA-N
Mol Weight 358.32 g/mol
Molecular Formula C16H17F3N2O4
Exact Mass 358.114042 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID Fne7I9sAs5C
Name 2,2,2-Trifluoroethyl 4-(4-ethoxyphenyl)-6-methyl-2-oxo-1,2,3,4-tetrahydro-5-pyrimidinecarboxylate
CAS Registry Number 313971-79-8
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C16H17F3N2O4
InChI InChI=1S/C16H17F3N2O4/c1-3-24-11-6-4-10(5-7-11)13-12(9(2)20-15(23)21-13)14(22)25-8-16(17,18)19/h4-7,13H,3,8H2,1-2H3,(H2,20,21,23)
InChIKey KOLLMAPRBSKZIK-UHFFFAOYSA-N
Molecular Weight 358.317 g/mol
SMILES N1C(NC(C(=C1C)C(OCC(F)(F)F)=O)c1ccc(cc1)OCC)=O
SPLASH splash10-000l-9550000000-41dfeb63b23f1e2a1d6f
Source of Spectrum AD-0-2532-0
Synonyms 2,2,2-trifluoroethyl 4-(4-ethoxyphenyl)-6-methyl-2-oxo-3,4-dihydro-1H-pyrimidine-5-carboxylate 2,2,2-tris(fluoranyl)ethyl 4-(4-ethoxyphenyl)-6-methyl-2-oxidanylidene-3,4-dihydro-1H-pyrimidine-5-carboxylate 2-keto-6-methyl-4-p-phenetyl-3,4-dihydro-1H-pyrimidine-5-carboxylic acid 2,2,2-trifluoroethyl ester 4-(4-Ethoxyphenyl)-6-methyl-2-oxo-3,4-dihydro-1H-pyrimidine-5-carboxylic acid 2,2,2-trifluoroethyl ester Pyrimidine-5-carboxylic acid, 1,2,3,4-tetrahydro-4-(4-ethoxyphenyl)-6-methyl-2-oxo-, 2,2,2-trifluoroethyl ester
Wiley ID 1426700