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1-[4-keto-5-methyl-2-(trifluoromethyl)quinazolin-3-yl]ethylenimine-2-carboxylic acid methyl ester
SpectraBase Compound ID 9LY2GV2iUMn
InChI InChI=1S/C14H12F3N3O3/c1-7-4-3-5-8-10(7)11(21)20(13(18-8)14(15,16)17)19-6-9(19)12(22)23-2/h3-5,9H,6H2,1-2H3
InChIKey CTTDVMBWEPLSGL-UHFFFAOYSA-N
Mol Weight 327.26 g/mol
Molecular Formula C14H12F3N3O3
Exact Mass 327.083076 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 1uHMPahxHza
Name 1-[4-keto-5-methyl-2-(trifluoromethyl)quinazolin-3-yl]ethylenimine-2-carboxylic acid methyl ester
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Formula C14H12F3N3O3
InChI InChI=1S/C14H12F3N3O3/c1-7-4-3-5-8-10(7)11(21)20(13(18-8)14(15,16)17)19-6-9(19)12(22)23-2/h3-5,9H,6H2,1-2H3
InChIKey CTTDVMBWEPLSGL-UHFFFAOYSA-N
Molecular Weight 327.263 g/mol
SMILES C1(N(N2C(=Nc3c(C2=O)c(ccc3)C)C(F)(F)F)C1)C(=O)OC
SPLASH splash10-01q9-9061000000-bf6737570220cc9c0b22
Source of Spectrum KC-0-775-24
Synonyms 1-[5-methyl-4-oxo-2-(trifluoromethyl)-3-quinazolinyl]-2-aziridinecarboxylic acid methyl ester Methyl 1-[5-methyl-4-oxidanylidene-2-(trifluoromethyl)quinazolin-3-yl]aziridine-2-carboxylate Methyl 1-[5-methyl-4-oxo-2-(trifluoromethyl)quinazolin-3-yl]aziridine-2-carboxylate
Wiley ID 828164