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1-(TRIFLUOROMETHYL)-7-BROMO-4-ADAMANTANONE
SpectraBase Compound ID KiXpg1pyEPU
InChI InChI=1S/C11H12BrF3O/c12-10-3-6-1-9(5-10,11(13,14)15)2-7(4-10)8(6)16/h6-7H,1-5H2/t6-,7+,9+,10-
InChIKey XTJSLVMRGHQPPN-SWOGREBESA-N
Mol Weight 297.12 g/mol
Molecular Formula C11H12BrF3O
Exact Mass 296.002362 g/mol

19F Nuclear Magnetic Resonance (NMR) Chemical Shifts

19F Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID 5oTObcyjjx4
Name 1-(TRIFLUOROMETHYL)-7-BROMO-4-ADAMANTANONE
Comments SCALE INVERTED
Copyright Copyright © 2002-2024 Wiley-VCH Verlag GmbH & Co. KGaA. All Rights Reserved.
Formula C11H12BrF3O
InChI InChI=1S/C11H12BrF3O/c12-10-3-6-1-9(5-10,11(13,14)15)2-7(4-10)8(6)16/h6-7H,1-5H2/t6-,7+,9+,10-
InChIKey XTJSLVMRGHQPPN-SWOGREBESA-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