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2,2,3,3,4,4,5,5,6,6,7,7,7-Tridecafluoro-1-phenyl-heptan-1-one
SpectraBase Compound ID LWEWsSGzkmJ
InChI InChI=1S/C13H5F13O/c14-8(15,7(27)6-4-2-1-3-5-6)9(16,17)10(18,19)11(20,21)12(22,23)13(24,25)26/h1-5H
InChIKey WEZRUJCIUIEOFU-UHFFFAOYSA-N
Mol Weight 424.16 g/mol
Molecular Formula C13H5F13O
Exact Mass 424.013281 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID CNLJkREJPb0
Name 2,2,3,3,4,4,5,5,6,6,7,7,7-Tridecafluoro-1-phenyl-heptan-1-one
Alternate Name(s) 2,2,3,3,4,4,5,5,6,6,7,7,7-tridecafluoro-1-phenyl-1-heptanone 2,2,3,3,4,4,5,5,6,6,7,7,7-tridecafluoro-1-phenylheptan-1-one
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Formula C13H5F13O
InChI InChI=1S/C13H5F13O/c14-8(15,7(27)6-4-2-1-3-5-6)9(16,17)10(18,19)11(20,21)12(22,23)13(24,25)26/h1-5H
InChIKey WEZRUJCIUIEOFU-UHFFFAOYSA-N
Molecular Weight 424.161 g/mol
SMILES C(C(C(C(=O)c1ccccc1)(F)F)(F)F)(C(C(C(F)(F)F)(F)F)(F)F)(F)F
SPLASH splash10-0a4i-0900000000-7f7767fc3b296c378517
Source of Spectrum U1-2010-7017-2t
Wiley ID 1664722