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5,12-METHANO-[2.2.2]-PARA-CYCLOPHAN-25-ONE

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5,12-METHANO-[2.2.2]-PARA-CYCLOPHAN-25-ONE
SpectraBase Compound ID E1YtiOE5Fs7
InChI InChI=1S/C25H22O/c26-25-23-15-19-7-5-17-1-2-18(4-3-17)6-8-20-10-12-22(24(25)16-20)14-13-21(23)11-9-19/h1-4,9-12,15-16H,5-8,13-14H2
InChIKey XVLFEOUQYMGPTM-UHFFFAOYSA-N
Mol Weight 338.45 g/mol
Molecular Formula C25H22O
Exact Mass 338.167065 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID 5xYuKCHierF
Name 5,12-METHANO-[2.2.2]-PARA-CYCLOPHAN-25-ONE
Compound Number 4
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C25H22O
InChI InChI=1S/C25H22O/c26-25-23-15-19-7-5-17-1-2-18(4-3-17)6-8-20-10-12-22(24(25)16-20)14-13-21(23)11-9-19/h1-4,9-12,15-16H,5-8,13-14H2
InChIKey XVLFEOUQYMGPTM-UHFFFAOYSA-N
Literature Reference Author F.R.HEIRTZLER,H.HOPF,P.G.JONES,P.BUBENITSCHEK,V.LEHNE
Literature Reference Citation J.ORG.CHEM.,58,2781(1993)
Literature Reference DOI 10.1021/jo00062a021
Molecular Weight 338.449 g/mol
Solvent CDCl3
Source File Reference UWRU736