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2,2'-DIHEXYL-3,3'-DIHYDROXY-6H,6'H-[4,4'-DIBENZO-[C]-CHROMENE]-6,6'-DIONE
SpectraBase Compound ID 9OOWWjRN1gM
InChI InChI=1S/C38H38O6/c1-3-5-7-9-15-23-21-29-25-17-11-13-19-27(25)37(41)43-35(29)31(33(23)39)32-34(40)24(16-10-8-6-4-2)22-30-26-18-12-14-20-28(26)38(42)44-36(30)32/h11-14,17-22,39-40H,3-10,15-16H2,1-2H3
InChIKey FTHPOIDSPBFCLF-UHFFFAOYSA-N
Mol Weight 590.7 g/mol
Molecular Formula C38H38O6
Exact Mass 590.266839 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID FNZMVpLF3HV
Name 2,2'-DIHEXYL-3,3'-DIHYDROXY-6H,6'H-[4,4'-DIBENZO-[C]-CHROMENE]-6,6'-DIONE
Compound Number 17
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C38H38O6
InChI InChI=1S/C38H38O6/c1-3-5-7-9-15-23-21-29-25-17-11-13-19-27(25)37(41)43-35(29)31(33(23)39)32-34(40)24(16-10-8-6-4-2)22-30-26-18-12-14-20-28(26)38(42)44-36(30)32/h11-14,17-22,39-40H,3-10,15-16H2,1-2H3
InChIKey FTHPOIDSPBFCLF-UHFFFAOYSA-N
Literature Reference Author M.KRZESZEWSKI,O.VAKULIK,D.T.GRYKO
Literature Reference Citation EUR.J.ORG.CHEM.,2013,5631(2013)
Literature Reference DOI 10.1002/ejoc.201300374
Molecular Weight 590.716 g/mol
Solvent CDCl3
Source File Reference UWBT17140