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3-Amino-2-(1,1,2,2,2-pentafluoroethyl)-4-quinazolinone
SpectraBase Compound ID IuMvuPHcnXD
InChI InChI=1S/C10H6F5N3O/c11-9(12,10(13,14)15)8-17-6-4-2-1-3-5(6)7(19)18(8)16/h1-4H,16H2
InChIKey ZDYLXNAIVKWKMW-UHFFFAOYSA-N
Mol Weight 279.17 g/mol
Molecular Formula C10H6F5N3O
Exact Mass 279.043103 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 8q12vatRRT9
Name 3-Amino-2-(1,1,2,2,2-pentafluoroethyl)-4-quinazolinone
Alternate Name(s) 3-Amino-2-(1,1,2,2,2-pentafluoroethyl)quinazolin-4-one 3-Azanyl-2-[1,1,2,2,2-pentakis(fluoranyl)ethyl]quinazolin-4-one
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Formula C10H6F5N3O
InChI InChI=1S/C10H6F5N3O/c11-9(12,10(13,14)15)8-17-6-4-2-1-3-5(6)7(19)18(8)16/h1-4H,16H2
InChIKey ZDYLXNAIVKWKMW-UHFFFAOYSA-N
Molecular Weight 279.170 g/mol
SMILES NN1C(C(C(F)(F)F)(F)F)=Nc2c(cccc2)C1=O
SPLASH splash10-0fb9-0090000000-2993b11ca2816912d7f7
Source of Spectrum KC-0-165-39
Wiley ID 784993