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2-(2,2,3,3,4,4,4-heptafluoro-1-oxobutoxy)benzoic acid ethyl ester
SpectraBase Compound ID D7FaGbriVLl
InChI InChI=1S/C13H9F7O4/c1-2-23-9(21)7-5-3-4-6-8(7)24-10(22)11(14,15)12(16,17)13(18,19)20/h3-6H,2H2,1H3
InChIKey PFWOWFJJFMBFIZ-UHFFFAOYSA-N
Mol Weight 362.2 g/mol
Molecular Formula C13H9F7O4
Exact Mass 362.038906 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID IrRWhYgEig6
Name 2-(2,2,3,3,4,4,4-heptafluoro-1-oxobutoxy)benzoic acid ethyl ester
Alternate Name(s) 2-(2,2,3,3,4,4,4-heptafluorobutanoyloxy)benzoic acid ethyl ester Ethyl 2-(2,2,3,3,4,4,4-heptafluorobutanoyloxy)benzoate Ethyl 2-[2,2,3,3,4,4,4-heptakis(fluoranyl)butanoyloxy]benzoate Ethyl salicylate heptafluorobutyrate
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Formula C13H9F7O4
InChI InChI=1S/C13H9F7O4/c1-2-23-9(21)7-5-3-4-6-8(7)24-10(22)11(14,15)12(16,17)13(18,19)20/h3-6H,2H2,1H3
InChIKey PFWOWFJJFMBFIZ-UHFFFAOYSA-N
Molecular Weight 362.200 g/mol
SMILES C(C(C(Oc1c(C(=O)OCC)cccc1)=O)(F)F)(C(F)(F)F)(F)F
SPLASH splash10-01b9-9502000000-78872edb25ea21e6183e
Source of Spectrum E-46-1933-22
Wiley ID 1349235