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(3.3)-Metacyclophane

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(3.3)-Metacyclophane
SpectraBase Compound ID 3L4ZBykx0ue
InChI InChI=1S/C18H20/c1-5-15-9-3-11-17-7-2-8-18(14-17)12-4-10-16(6-1)13-15/h1-2,5-8,13-14H,3-4,9-12H2
InChIKey HXRHCTOUBIUFEE-UHFFFAOYSA-N
Mol Weight 236.36 g/mol
Molecular Formula C18H20
Exact Mass 236.156501 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID 6CI3RlxE3xY
Name (3.3)-Metacyclophane
CAS Registry Number 62155-71-9
Copyright Copyright © 2002-2024 Wiley-VCH Verlag GmbH & Co. KGaA. All Rights Reserved.
Formula C18H20
InChI InChI=1S/C18H20/c1-5-15-9-3-11-17-7-2-8-18(14-17)12-4-10-16(6-1)13-15/h1-2,5-8,13-14H,3-4,9-12H2
InChIKey HXRHCTOUBIUFEE-UHFFFAOYSA-N
Instrument Name Varian CFT-20
Literature Reference M.F. Semmelhack, J.J. Harrison, D.C.Young, J. Am. Chem. Soc. 107, 7508 (1985).
NMR Standard TMS
Origin Chemical Concepts. A Wiley Division. Weinheim, Germany
Solvent CD2Cl2