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11-tert-Butyl-8-chloro-[5]metacyclophane

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11-tert-Butyl-8-chloro-[5]metacyclophane
SpectraBase Compound ID IykXcPqqGUH
InChI InChI=1S/C15H21Cl/c1-15(2,3)14-11-7-5-4-6-8-12(14)10-13(16)9-11/h9-10H,4-8H2,1-3H3
InChIKey GKJGFPGSWCIGEV-UHFFFAOYSA-N
Mol Weight 236.79 g/mol
Molecular Formula C15H21Cl
Exact Mass 236.133178 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID F7ZYr8DgvAJ
Name 11-tert-Butyl-8-chloro-[5]metacyclophane
CAS Registry Number 93847-09-7
Copyright Copyright © 2002-2024 Wiley-VCH Verlag GmbH & Co. KGaA. All Rights Reserved.
Formula C15H21Cl
InChI InChI=1S/C15H21Cl/c1-15(2,3)14-11-7-5-4-6-8-12(14)10-13(16)9-11/h9-10H,4-8H2,1-3H3
InChIKey GKJGFPGSWCIGEV-UHFFFAOYSA-N
Literature Reference L.W. Jenneskens, J. Klamer, F. Bickelhaupt, J. Chem. Soc. Chem. Comm. 733 (1984)
NMR Standard TMS
Origin Chemical Concepts. A Wiley Division. Weinheim, Germany
Solvent CDCl3