For citations & permissions, please see: Citations & Permissions - Wiley Science Solutions*

*Links on SpectraBase are not permalinks.
1-(4-Chlorophenyl)-3-(4-(trifluoromethyl)benzyl)-1H-pyrimido[2,1-b]quinazoline-2,6-dione
SpectraBase Compound ID BxA2cVDsMMt
InChI InChI=1S/C25H15ClF3N3O2/c26-18-9-11-19(12-10-18)32-22(33)16(13-15-5-7-17(8-6-15)25(27,28)29)14-31-23(34)20-3-1-2-4-21(20)30-24(31)32/h1-12,14H,13H2
InChIKey RFUDHYWCZFZYKD-UHFFFAOYSA-N
Mol Weight 481.86 g/mol
Molecular Formula C25H15ClF3N3O2
Exact Mass 481.080489 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

View the Full Spectrum for FREE!

The full spectrum can only be viewed using a FREE account.

SpectraBase Spectrum ID 6ZCb1YGPVQZ
Name 1-(4-Chlorophenyl)-3-(4-(trifluoromethyl)benzyl)-1H-pyrimido[2,1-b]quinazoline-2,6-dione
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C25H15ClF3N3O2
InChI InChI=1S/C25H15ClF3N3O2/c26-18-9-11-19(12-10-18)32-22(33)16(13-15-5-7-17(8-6-15)25(27,28)29)14-31-23(34)20-3-1-2-4-21(20)30-24(31)32/h1-12,14H,13H2
InChIKey RFUDHYWCZFZYKD-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)Cl)=O)Cc1ccc(cc1)C(F)(F)F)=O
SPLASH splash10-001i-0100900000-d671ee9573b0430496b0
Source of Spectrum F-71-422-9h
Synonyms 1-(4-Chlorophenyl)-3-(4-(trifluoromethyl)benzyl)-2H-pyrimido[2,1-b]quinazoline-2,6(1H)-dione
Wiley ID 1803027