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1-AMINO-2,4-BIS(1-HYDROXY-1-TRIFLUOROMETHYL-2,2,2-TRIFLUOROETHYL)NAPHTHALENE
SpectraBase Compound ID 8ZnnLGURN1W
InChI InChI=1S/C16H9F12NO2/c17-13(18,19)11(30,14(20,21)22)8-5-9(10(29)7-4-2-1-3-6(7)8)12(31,15(23,24)25)16(26,27)28/h1-5,30-31H,29H2
InChIKey IFGCOSAMEBUJDO-UHFFFAOYSA-N
Mol Weight 475.23 g/mol
Molecular Formula C16H9F12NO2
Exact Mass 475.044166 g/mol

19F Nuclear Magnetic Resonance (NMR) Chemical Shifts

19F Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID LUmBzoQqxnv
Name 1-AMINO-2,4-BIS(1-HYDROXY-1-TRIFLUOROMETHYL-2,2,2-TRIFLUOROETHYL)NAPHTHALENE
Comments 1J(C-F) FOR 13C SHIFTS: 124.6(286.4), 125.1(288.2). SCALE INVERTED;WP-200SY (BRUKER)
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Formula C16H9F12NO2
InChI InChI=1S/C16H9F12NO2/c17-13(18,19)11(30,14(20,21)22)8-5-9(10(29)7-4-2-1-3-6(7)8)12(31,15(23,24)25)16(26,27)28/h1-5,30-31H,29H2
InChIKey IFGCOSAMEBUJDO-UHFFFAOYSA-N
Instrument Name SEE COMMENT
Literature Reference N.D.CHKANIKOV, V.D.SVIRIDOV, A.E.ZELENIN, M.V.GALAKHOV, A.F.KOLOMIETS,A.V.FOKIN (1990) Izv.Akad.Nauk SSSR(Russ. Lang.): N2, 383-389.
NMR Standard -CF3COOH external
Observed nucleus 19F
Origin Chemical Concepts. A Wiley Division. Weinheim, Germany
Solvent C3H6O acetone