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1-(TRIFLUOROMETHYL)-4,4-DIBROMOADAMANTANE
SpectraBase Compound ID GredyGJQZc3
InChI InChI=1S/C11H13Br2F3/c12-10(13)7-1-6-2-8(10)5-9(3-6,4-7)11(14,15)16/h6-8H,1-5H2/t6-,7-,8+,9-
InChIKey XLGNZJJPUIRDDD-GJFBTZRYSA-N
Mol Weight 362.03 g/mol
Molecular Formula C11H13Br2F3
Exact Mass 359.933611 g/mol

19F Nuclear Magnetic Resonance (NMR) Chemical Shifts

19F Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID KVBFAqzpyZE
Name 1-(TRIFLUOROMETHYL)-4,4-DIBROMOADAMANTANE
Comments SCALE INVERTED
Copyright Copyright © 2002-2024 Wiley-VCH Verlag GmbH & Co. KGaA. All Rights Reserved.
Formula C11H13Br2F3
InChI InChI=1S/C11H13Br2F3/c12-10(13)7-1-6-2-8(10)5-9(3-6,4-7)11(14,15)16/h6-8H,1-5H2/t6-,7-,8+,9-
InChIKey XLGNZJJPUIRDDD-GJFBTZRYSA-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