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[8.8]-(1,4)-CYCLOOCTATETRAENOPHANE
SpectraBase Compound ID ISRYeCBfuU7
InChI InChI=1S/C32H20/c1-2-6-10-18-30-22-15-16-24-32(28-27-30)20-12-8-4-3-7-11-19-31-23-14-13-21-29(25-26-31)17-9-5-1/h9-28H/b14-13-,16-15-,17-9-,18-10-,19-11-,20-12-,21-13-,22-15-,23-14-,24-16-,26-25-,28-27-,29-17-,29-21-,29-25-,30-18-,30-22-,30-27-,31-19-,31-23-,31-26-,32-20-,32-24-,32-28-
InChIKey VTOQXDYYIUQQCV-CPNMBJNQSA-N
Mol Weight 404.5 g/mol
Molecular Formula C32H20
Exact Mass 404.156501 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID 2MwJO5LNT2F
Name [8.8]-(1,4)-CYCLOOCTATETRAENOPHANE
Compound Number 2
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C32H20
InChI InChI=1S/C32H20/c1-2-6-10-18-30-22-15-16-24-32(28-27-30)20-12-8-4-3-7-11-19-31-23-14-13-21-29(25-26-31)17-9-5-1/h9-28H/b14-13-,16-15-,17-9-,18-10-,19-11-,20-12-,21-13-,22-15-,23-14-,24-16-,26-25-,28-27-,29-17-,29-21-,29-25-,30-18-,30-22-,30-27-,31-19-,31-23-,31-26-,32-20-,32-24-,32-28-
InChIKey VTOQXDYYIUQQCV-CPNMBJNQSA-N
Literature Reference Author R.M.MORIARTY,D.PAVLOVIC
Literature Reference Citation J.ORG.CHEM.,69,5501(2004)
Literature Reference DOI 10.1021/jo049643d
Molecular Weight 404.511 g/mol
Solvent ACETONE-D6
Source File Reference UWVN22146