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1-(4-fluorophenyl)-7,7-dimethyl-4,4-bis(trifluoromethyl)-1,2,3,4,5,6,7,8-octahydroquinazoline-2,5-dione
SpectraBase Compound ID 2N3JPbRujNT
InChI InChI=1S/C18H15F7N2O2/c1-15(2)7-11-13(12(28)8-15)16(17(20,21)22,18(23,24)25)26-14(29)27(11)10-5-3-9(19)4-6-10/h3-6H,7-8H2,1-2H3,(H,26,29)
InChIKey NOJNAJJRIVJHQE-UHFFFAOYSA-N
Mol Weight 424.32 g/mol
Molecular Formula C18H15F7N2O2
Exact Mass 424.102175 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID HtC4TrtD2OI
Name 1-(4-fluorophenyl)-7,7-dimethyl-4,4-bis(trifluoromethyl)-1,2,3,4,5,6,7,8-octahydroquinazoline-2,5-dione
Alternate Name(s) 2,5(1H,3H)-Quinazolinedione, 1-(4-fluorophenyl)-4,6,7,8-tetrahydro-7,7-dimethyl-4,4-bis(trifluoromethyl)- 1-(4-fluorophenyl)-7,7-dimethyl-4,4-bis(trifluoromethyl)-6,8-dihydro-3H-quinazoline-2,5-dione
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Formula C18H15F7N2O2
InChI InChI=1S/C18H15F7N2O2/c1-15(2)7-11-13(12(28)8-15)16(17(20,21)22,18(23,24)25)26-14(29)27(11)10-5-3-9(19)4-6-10/h3-6H,7-8H2,1-2H3,(H,26,29)
InChIKey NOJNAJJRIVJHQE-UHFFFAOYSA-N
Molecular Weight 424.319 g/mol
SMILES N1C(N(C=2CC(CC(C2C1(C(F)(F)F)C(F)(F)F)=O)(C)C)c1ccc(cc1)F)=O
SPLASH splash10-0a4i-9524000000-0a9d8eab37d0c1272e1b
Source of Spectrum IY-2-5059-1
Wiley ID 1658574