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BUTYL(PERFLUORO-1,4-DIMETHYL-2,5-DIOXAOCTYL)KETONE
SpectraBase Compound ID 5yF4kqgHl5b
InChI InChI=1S/C13H9F17O3/c1-2-3-4-5(31)6(14,9(18,19)20)32-13(29,30)8(17,11(24,25)26)33-12(27,28)7(15,16)10(21,22)23/h2-4H2,1H3
InChIKey MGBAGUSNXCXPGL-UHFFFAOYSA-N
Mol Weight 536.18 g/mol
Molecular Formula C13H9F17O3
Exact Mass 536.028023 g/mol

19F Nuclear Magnetic Resonance (NMR) Chemical Shifts

19F Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID KtRhsLJgZsu
Name BUTYL(PERFLUORO-1,4-DIMETHYL-2,5-DIOXAOCTYL)KETONE
Comments SCALE INVERTED. NAME DEFINED. -3.6, -4.2, -53.1, -58.5, -67.9 WERE
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Formula C13H9F17O3
InChI InChI=1S/C13H9F17O3/c1-2-3-4-5(31)6(14,9(18,19)20)32-13(29,30)8(17,11(24,25)26)33-12(27,28)7(15,16)10(21,22)23/h2-4H2,1H3
InChIKey MGBAGUSNXCXPGL-UHFFFAOYSA-N
Instrument Name Varian EM-360
Literature Reference QING-YUN CHEN, JIAN-GUO CHEN (1989) J.Fluor.Chem.: v.42, N3, 355-370.
NMR Standard -CF3COOH
Observed nucleus 19F
Origin Chemical Concepts. A Wiley Division. Weinheim, Germany
Solvent not reported