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4-PERFLUOROHEPTYL-5,7-DIHYDROXYCOUMARIN
SpectraBase Compound ID FWykO3oVQdA
InChI InChI=1S/C16H5F15O4/c17-10(18,5-3-8(34)35-7-2-4(32)1-6(33)9(5)7)11(19,20)12(21,22)13(23,24)14(25,26)15(27,28)16(29,30)31/h1-3,32-33H
InChIKey JBHSXMNSVULINH-UHFFFAOYSA-N
Mol Weight 546.19 g/mol
Molecular Formula C16H5F15O4
Exact Mass 545.994831 g/mol

19F Nuclear Magnetic Resonance (NMR) Chemical Shifts

19F Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID 46GNIsvmt8F
Name 4-PERFLUOROHEPTYL-5,7-DIHYDROXYCOUMARIN
Comments C=0.5M, RANGE -119.7...-122.6PPM FOR OTHER CF2
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Formula C16H5F15O4
InChI InChI=1S/C16H5F15O4/c17-10(18,5-3-8(34)35-7-2-4(32)1-6(33)9(5)7)11(19,20)12(21,22)13(23,24)14(25,26)15(27,28)16(29,30)31/h1-3,32-33H
InChIKey JBHSXMNSVULINH-UHFFFAOYSA-N
Instrument Name Bruker WH-90
Literature Reference V.BAYER, R.PASTOR, A.CAMBON (1982) J.Fluor.Chem.: v.20, N2, 187-202.
NMR Standard CCl3F
Observed nucleus 19F
Origin Chemical Concepts. A Wiley Division. Weinheim, Germany
Solvent C3D6O acetone-d6