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6,6-DIHEXYL-6H-CYCLOPENTA-[1,2-B:5,4-B']-DIFLUORENE-12,15-DIONE
SpectraBase Compound ID BJbu9yNfQUa
InChI InChI=1S/C39H38O2/c1-3-5-7-13-19-39(20-14-8-6-4-2)35-23-29-25-15-9-11-17-27(25)37(40)33(29)21-31(35)32-22-34-30(24-36(32)39)26-16-10-12-18-28(26)38(34)41/h9-12,15-18,21-24H,3-8,13-14,19-20H2,1-2H3
InChIKey PNAPGPOLIKKLTE-UHFFFAOYSA-N
Mol Weight 538.7 g/mol
Molecular Formula C39H38O2
Exact Mass 538.28718 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID BySjtmHSpkl
Name 6,6-DIHEXYL-6H-CYCLOPENTA-[1,2-B:5,4-B']-DIFLUORENE-12,15-DIONE
Compound Number 6
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C39H38O2
InChI InChI=1S/C39H38O2/c1-3-5-7-13-19-39(20-14-8-6-4-2)35-23-29-25-15-9-11-17-27(25)37(40)33(29)21-31(35)32-22-34-30(24-36(32)39)26-16-10-12-18-28(26)38(34)41/h9-12,15-18,21-24H,3-8,13-14,19-20H2,1-2H3
InChIKey PNAPGPOLIKKLTE-UHFFFAOYSA-N
Literature Reference Author T.C.LIN,M.L.LI,C.Y.LIU,M.Y.TSAI,Y.H.LEE,Y.FEBRIANI,J.H.LIN,Y .K.SHEN
Literature Reference Citation EUR.J.ORG.CHEM.,2014,1615(2014)
Literature Reference DOI 10.1002/ejoc.201301290
Molecular Weight 538.730 g/mol
Solvent CDCl3
Source File Reference UWIR20031