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3-(4-(Trifluoromethyl)benzyl)-1-(p-tolyl)-1H-pyrimido[2,1-b] quinazoline-2,6-dione
SpectraBase Compound ID Gt6zuD1JxkA
InChI InChI=1S/C26H18F3N3O2/c1-16-6-12-20(13-7-16)32-23(33)18(14-17-8-10-19(11-9-17)26(27,28)29)15-31-24(34)21-4-2-3-5-22(21)30-25(31)32/h2-13,15H,14H2,1H3
InChIKey ZOLIHEMTHCAMCI-UHFFFAOYSA-N
Mol Weight 461.44 g/mol
Molecular Formula C26H18F3N3O2
Exact Mass 461.135111 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID FgmWTaDS9Zr
Name 3-(4-(Trifluoromethyl)benzyl)-1-(p-tolyl)-1H-pyrimido[2,1-b] quinazoline-2,6-dione
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Formula C26H18F3N3O2
InChI InChI=1S/C26H18F3N3O2/c1-16-6-12-20(13-7-16)32-23(33)18(14-17-8-10-19(11-9-17)26(27,28)29)15-31-24(34)21-4-2-3-5-22(21)30-25(31)32/h2-13,15H,14H2,1H3
InChIKey ZOLIHEMTHCAMCI-UHFFFAOYSA-N
Molecular Weight 461.444 g/mol
SMILES C12=Nc3ccccc3C(N2C=C(C(N1c1ccc(cc1)C)=O)Cc1ccc(cc1)C(F)(F)F)=O
SPLASH splash10-03di-0001900000-46f19af56bac91949b3b
Source of Spectrum F-71-422-9m
Synonyms 1-(p-tolyl)-3-(4-(trifluoromethyl)benzyl)-2H-pyrimido[2,1-b]quinazoline-2,6(1H)-dione
Wiley ID 1803032