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8,11-DIBROMO-[5]-METACYCLOPHANE;(KONFORMER-A)
SpectraBase Compound ID CfMMCYQvzoN
InChI InChI=1S/C11H12Br2/c12-10-6-8-4-2-1-3-5-9(7-10)11(8)13/h6-7H,1-5H2
InChIKey XGHZGBDDSQBROP-UHFFFAOYSA-N
Mol Weight 304.03 g/mol
Molecular Formula C11H12Br2
Exact Mass 301.930576 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID EeiGmxOQ7cZ
Name 8,11-Dibromo-(5)metacyclophane
CAS Registry Number 96426-52-7
Comments CONFORMER 2
Copyright Copyright © 2002-2024 Wiley-VCH Verlag GmbH & Co. KGaA. All Rights Reserved.
Formula C11H12Br2
InChI InChI=1S/C11H12Br2/c12-10-6-8-4-2-1-3-5-9(7-10)11(8)13/h6-7H,1-5H2
InChIKey XGHZGBDDSQBROP-UHFFFAOYSA-N
Instrument Name Bruker WM-250
Literature Reference L.W. Jenneskens, F. Bickelhaupt, Magn. Res. Chem. 24, 308 (1986).
NMR Standard CDCl3
Origin Chemical Concepts. A Wiley Division. Weinheim, Germany
Solvent CDCl3