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6'',8'-BISDIOSQUINONE

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6'',8'-BISDIOSQUINONE
SpectraBase Compound ID CifT5ItIAue
InChI InChI=1S/2C44H26O14/c2*1-11-5-15-27(20(45)6-11)21(46)10-19(32(15)48)25-14(4)26(30-31(37(25)53)40(56)44-43(58-44)39(30)55)24-13(3)8-16-28(36(24)52)22(47)9-18(33(16)49)23-12(2)7-17-29(35(23)51)38(54)42-41(57-42)34(17)50/h2*5-10,41-45,51-53H,1-4H3
InChIKey VLNMVLYWMNXPII-UHFFFAOYSA-N
Mol Weight 1557.4 g/mol
Molecular Formula C88H52O28
Exact Mass 1556.264511 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID 2wVJwO8wZkX
Name 6'',8'-BISDIOSQUINONE
Compound Number 1
Copyright Copyright © 2016-2025 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C88H52O28
InChI InChI=1S/2C44H26O14/c2*1-11-5-15-27(20(45)6-11)21(46)10-19(32(15)48)25-14(4)26(30-31(37(25)53)40(56)44-43(58-44)39(30)55)24-13(3)8-16-28(36(24)52)22(47)9-18(33(16)49)23-12(2)7-17-29(35(23)51)38(54)42-41(57-42)34(17)50/h2*5-10,41-45,51-53H,1-4H3
InChIKey VLNMVLYWMNXPII-UHFFFAOYSA-N
Literature Reference Author R.M.KHAN,E.RWEKIKA
Literature Reference Citation PHYTOCHEM.,50,143(1999)
Literature Reference DOI 10.1016/S0031-9422(98)00491-9
Molecular Weight 1557.364 g/mol
Solvent Unknown