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Methyl perfluorooctanoate
SpectraBase Compound ID FHBPggJJfuH
InChI InChI=1S/C9H3F15O2/c1-26-2(25)3(10,11)4(12,13)5(14,15)6(16,17)7(18,19)8(20,21)9(22,23)24/h1H3
InChIKey XOCNYZFAMHDXJK-UHFFFAOYSA-N
Mol Weight 428.1 g/mol
Molecular Formula C9H3F15O2
Exact Mass 427.989352 g/mol

19F Nuclear Magnetic Resonance (NMR) Chemical Shifts

19F Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID E3jE93IDCTP
Name METHYL PERFLUOROOCTANOATE
Comments -45.8:-46.5 - RANGE. STANDARD IS DEDUCED TO BE CF3COOH. SCALE
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Formula C9H3F15O2
InChI InChI=1S/C9H3F15O2/c1-26-2(25)3(10,11)4(12,13)5(14,15)6(16,17)7(18,19)8(20,21)9(22,23)24/h1H3
InChIKey XOCNYZFAMHDXJK-UHFFFAOYSA-N
Instrument Name Jeol FX-90
Literature Reference CHANG-MING HU, ZE-QI XU, WEI-YUAN HUANG (1990) J.Fluor.Chem.: v.49, N3, 433-437.
NMR Standard -CF3COOH
Observed nucleus 19F
Origin Chemical Concepts. A Wiley Division. Weinheim, Germany
Solvent NEAT