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2-Phenyl-7-(trifluoromethyl)-4H-pyrido[1,2-a]pyrimidin-4-one
SpectraBase Compound ID LJccfw2ntob
InChI InChI=1S/C15H9F3N2O/c16-15(17,18)11-6-7-13-19-12(8-14(21)20(13)9-11)10-4-2-1-3-5-10/h1-9H
InChIKey PUHKYYRQBAJVFR-UHFFFAOYSA-N
Mol Weight 290.25 g/mol
Molecular Formula C15H9F3N2O
Exact Mass 290.066697 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID jx3SOennnh
Name 2-Phenyl-7-(trifluoromethyl)-4H-pyrido[1,2-a]pyrimidin-4-one
Appearance Colorless solid
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Exact Mass 290.066697406 u
Formula C15H9F3N2O
InChI InChI=1S/C15H9F3N2O/c16-15(17,18)11-6-7-13-19-12(8-14(21)20(13)9-11)10-4-2-1-3-5-10/h1-9H
InChIKey PUHKYYRQBAJVFR-UHFFFAOYSA-N
Instrument Name Jeol AccuTOF
Ionization Type EI
Literature Reference DOI 10.1002/anie.201801111
Molecular Weight 290.245 g/mol
Quality 52
Reported Formula C15H9F3N2O
SMILES C(C=1C=CC=2N(C(C=C(N2)C2=CC=CC=C2)=O)C1)(F)(F)F
SPLASH splash10-03dl-0190000000-ec3912920ad8b9875c35
Source of Spectrum ACI-57-SM27-3ka (DOI: 10.1002/anie.201801111)
Wiley ID 1892994