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3-(4-Chlorobenzyl)-1-(4-(trifluoromethyl)phenyl)-1H-pyrimido[2,1-b]quinazoline-2,6-dione

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3-(4-Chlorobenzyl)-1-(4-(trifluoromethyl)phenyl)-1H-pyrimido[2,1-b]quinazoline-2,6-dione
SpectraBase Compound ID JC9GEx1jA0y
InChI InChI=1S/C25H15ClF3N3O2/c26-18-9-5-15(6-10-18)13-16-14-31-23(34)20-3-1-2-4-21(20)30-24(31)32(22(16)33)19-11-7-17(8-12-19)25(27,28)29/h1-12,14H,13H2
InChIKey MWJUVQPMMYIRSG-UHFFFAOYSA-N
Mol Weight 481.86 g/mol
Molecular Formula C25H15ClF3N3O2
Exact Mass 481.080489 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 32f60eC0BuV
Name 3-(4-Chlorobenzyl)-1-(4-(trifluoromethyl)phenyl)-1H-pyrimido[2,1-b]quinazoline-2,6-dione
Alternate Name(s) 3-(4-Chlorobenzyl)-1-(4-(trifluoromethyl)phenyl)-2H-pyrimido[2,1-b]quinazoline-2,6(1H)-dione
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C25H15ClF3N3O2
InChI InChI=1S/C25H15ClF3N3O2/c26-18-9-5-15(6-10-18)13-16-14-31-23(34)20-3-1-2-4-21(20)30-24(31)32(22(16)33)19-11-7-17(8-12-19)25(27,28)29/h1-12,14H,13H2
InChIKey MWJUVQPMMYIRSG-UHFFFAOYSA-N
Literature Reference DOI 10.1016/j.tet.2014.12.006
Molecular Weight 481.862 g/mol
SMILES C12=Nc3ccccc3C(N2C=C(C(N1c1ccc(cc1)C(F)(F)F)=O)Cc1ccc(cc1)Cl)=O
SPLASH splash10-001i-0201900000-d74f4715dba56a8e2428
Source of Spectrum F-71-421-9d
Wiley ID 1803023