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4-(2,2,2-trifluoroethoxy)-2-(trifluoromethyl)quinoline
SpectraBase Compound ID GOiSakKlteA
InChI InChI=1S/C12H7F6NO/c13-11(14,15)6-20-9-5-10(12(16,17)18)19-8-4-2-1-3-7(8)9/h1-5H,6H2
InChIKey KYHUFRXROFWZRL-UHFFFAOYSA-N
Mol Weight 295.18 g/mol
Molecular Formula C12H7F6NO
Exact Mass 295.043183 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 1EGy2KfcB2X
Name 4-(2,2,2-trifluoroethoxy)-2-(trifluoromethyl)quinoline
Appearance White solid
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Exact Mass 295.043182826 u
Formula C12H7F6NO
InChI InChI=1S/C12H7F6NO/c13-11(14,15)6-20-9-5-10(12(16,17)18)19-8-4-2-1-3-7(8)9/h1-5H,6H2
InChIKey KYHUFRXROFWZRL-UHFFFAOYSA-N
Ionization Type EI
Literature Reference DOI 10.1002/chem.201704205
Molecular Weight 295.184 g/mol
Quality 454
Reported Formula C12H7F6NO
SMILES C12=NC(=CC(=C2C=CC=C1)OCC(F)(F)F)C(F)(F)F
SPLASH splash10-0032-1970000000-8627b5baca31fcc45375
Source of Spectrum QE-23-SM16-4c (DOI: 10.1002/chem.201704205)
Thin-Layer Chromatography 0.44 (hex/EtOAc, 4:1)
Wiley ID 1905991