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1-BROMO-5,5-BIS(TRIFLUOROMETHYL)-6,6,7,7,8,8,8-HEPTAFLUORO-1,3-DIPHENYLOCTADIENE-1,3
SpectraBase Compound ID 3TziM8ojHHt
InChI InChI=1S/C22H12BrF13/c23-16(14-9-5-2-6-10-14)11-15(13-7-3-1-4-8-13)12-17(20(28,29)30,21(31,32)33)18(24,25)19(26,27)22(34,35)36/h1-12H/b15-12+,16-11+
InChIKey ZMVPVOFRALVIGY-KSELWQEASA-N
Mol Weight 603.22 g/mol
Molecular Formula C22H12BrF13
Exact Mass 601.99148 g/mol

19F Nuclear Magnetic Resonance (NMR) Chemical Shifts

19F Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID Dthi4LZiod
Name 1-BROMO-5,5-BIS(TRIFLUOROMETHYL)-6,6,7,7,8,8,8-HEPTAFLUORO-1,3-DIPHENYLOCTADIENE-1,3
Comments SCALE INVERTED;WP-200SY (BRUKER)
Copyright Copyright © 2002-2024 Wiley-VCH Verlag GmbH & Co. KGaA. All Rights Reserved.
Formula C22H12BrF13
InChI InChI=1S/C22H12BrF13/c23-16(14-9-5-2-6-10-14)11-15(13-7-3-1-4-8-13)12-17(20(28,29)30,21(31,32)33)18(24,25)19(26,27)22(34,35)36/h1-12H/b15-12+,16-11+
InChIKey ZMVPVOFRALVIGY-KSELWQEASA-N
Instrument Name SEE COMMENT
Literature Reference I.N.ROZHKOV, I.V.CHAPLINA (1991) Izv.Akad.Nauk SSSR(Russ. Lang.): N12, 2810-2815.
NMR Standard -CF3COOH
Observed nucleus 19F
Origin Chemical Concepts. A Wiley Division. Weinheim, Germany
Solvent C3D6O acetone-d6