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1-(TRIFLUOROMETHYL)-4,4,7-TRIBROMOADAMANTANE
SpectraBase Compound ID 8lEBjZaXjWG
InChI InChI=1S/C11H12Br3F3/c12-9-3-6-1-8(5-9,11(15,16)17)2-7(4-9)10(6,13)14/h6-7H,1-5H2/t6-,7+,8+,9-
InChIKey YJDMBIOTWXVTIL-OJOKCITNSA-N
Mol Weight 440.92 g/mol
Molecular Formula C11H12Br3F3
Exact Mass 437.844124 g/mol

19F Nuclear Magnetic Resonance (NMR) Chemical Shifts

19F Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID 8dMVUqdklms
Name 1-(TRIFLUOROMETHYL)-4,4,7-TRIBROMOADAMANTANE
Comments SCALE INVERTED
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Formula C11H12Br3F3
InChI InChI=1S/C11H12Br3F3/c12-9-3-6-1-8(5-9,11(15,16)17)2-7(4-9)10(6,13)14/h6-7H,1-5H2/t6-,7+,8+,9-
InChIKey YJDMBIOTWXVTIL-OJOKCITNSA-N
Instrument Name Tesla BS487
Literature Reference A.E.SOROCHINSKY, A.S.TARASEVICH, A.M.ALEXANDROV, V.P.KUKHAR' (1981)Zhurn.Org.Khim.(Russ. Lang.): v.17, N11, 2339-2343.
NMR Standard -CF3COOH external
Observed nucleus 19F
Origin Chemical Concepts. A Wiley Division. Weinheim, Germany
Solvent not reported