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2,3-DIHEXADECYLOXYTETRACENE-5,12-QUINONE

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2,3-DIHEXADECYLOXYTETRACENE-5,12-QUINONE
SpectraBase Compound ID 5Z3itfFQRyf
InChI InChI=1S/C50H74O4/c1-3-5-7-9-11-13-15-17-19-21-23-25-27-31-35-53-47-39-45-46(50(52)44-38-42-34-30-29-33-41(42)37-43(44)49(45)51)40-48(47)54-36-32-28-26-24-22-20-18-16-14-12-10-8-6-4-2/h29-30,33-34,37-40H,3-28,31-32,35-36H2,1-2H3
InChIKey YYCALHLOAKNBSE-UHFFFAOYSA-N
Mol Weight 739.1 g/mol
Molecular Formula C50H74O4
Exact Mass 738.558711 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID 9ZSrVTA4PrS
Name 2,3-DIHEXADECYLOXYTETRACENE-5,12-QUINONE
Compound Number 7
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C50H74O4
InChI InChI=1S/C50H74O4/c1-3-5-7-9-11-13-15-17-19-21-23-25-27-31-35-53-47-39-45-46(50(52)44-38-42-34-30-29-33-41(42)37-43(44)49(45)51)40-48(47)54-36-32-28-26-24-22-20-18-16-14-12-10-8-6-4-2/h29-30,33-34,37-40H,3-28,31-32,35-36H2,1-2H3
InChIKey YYCALHLOAKNBSE-UHFFFAOYSA-N
Literature Reference Author J.REICHWAGEN,H.HOPF,A.D.GUERZO,C.BELIN,H.BOUAS-LAURENT,J.P.D ESVERGNE
Literature Reference Citation ORG.LETTERS,7,971(2005)
Literature Reference DOI 10.1021/ol047526z
Molecular Weight 739.135 g/mol
Sample ID 42476
Solvent CDCl3