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3-BROMO-1,1,1,5,5,5-HEXACHLOROPENTAN
SpectraBase Compound ID FjZggYBtdGY
InChI InChI=1S/C5H5BrCl6/c6-3(1-4(7,8)9)2-5(10,11)12/h3H,1-2H2
InChIKey QFDXVAKTQHXJSD-UHFFFAOYSA-N
Mol Weight 357.7 g/mol
Molecular Formula C5H5BrCl6
Exact Mass 353.770579 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID JhWilF58GWe
Name 3-Bromo-1,1,1,5,5,5-hexachloro-pentane
CAS Registry Number 27802-71-7
Copyright Copyright © 2002-2024 Wiley-VCH Verlag GmbH & Co. KGaA. All Rights Reserved.
Formula C5H5BrCl6
InChI InChI=1S/C5H5BrCl6/c6-3(1-4(7,8)9)2-5(10,11)12/h3H,1-2H2
InChIKey QFDXVAKTQHXJSD-UHFFFAOYSA-N
Instrument Name Bruker HX-90
Literature Reference V.I. Dostovalova, F.K. Velichko, Org. Magn. Resonance 16, 251 (1981).
NMR Standard CHCl3
Origin Chemical Concepts. A Wiley Division. Weinheim, Germany
Solvent Neat liquid