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1,1,1-trifluoro-3-(2-quinolinyl)-2-propanone
SpectraBase Compound ID DMZOvX1XAXe
InChI InChI=1S/C12H8F3NO/c13-12(14,15)11(17)7-9-6-5-8-3-1-2-4-10(8)16-9/h1-6H,7H2
InChIKey LVPPHTPGIQXDGP-UHFFFAOYSA-N
Mol Weight 239.2 g/mol
Molecular Formula C12H8F3NO
Exact Mass 239.055798 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID BG8tIbOJalq
Name 1,1,1-trifluoro-3-(2-quinolinyl)-2-propanone
Alternate Name(s) 1,1,1-trifluoro-3-(2-quinolyl)acetone 1,1,1-trifluoro-3-(2-quinolyl)propan-2-one 1,1,1-trifluoro-3-quinolin-2-ylpropan-2-one 1,1,1-tris(fluoranyl)-3-quinolin-2-yl-propan-2-one
Comments Less than 3 mono-isotopic peaks
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Formula C12H8F3NO
InChI InChI=1S/C12H8F3NO/c13-12(14,15)11(17)7-9-6-5-8-3-1-2-4-10(8)16-9/h1-6H,7H2
InChIKey LVPPHTPGIQXDGP-UHFFFAOYSA-N
Molecular Weight 239.197 g/mol
SMILES C(C(Cc1nc2c(cc1)cccc2)=O)(F)(F)F
SPLASH splash10-00dr-0970000000-a7b07f77c79264ddc9c5
Source of Spectrum H1-48-2108-2
Wiley ID 816649