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4,5,6-TRI-TERT.-BUTYLBICYCLO-[2.2.0]-HEXA-2,5-DIENE-1,2,3-TRICARBOXYLIC-ACID,1-TERT.-BUTYLESTER-2,3-DIMETHYLESTER
SpectraBase Compound ID Jo4a7aIIdaI
InChI InChI=1S/C27H42O6/c1-22(2,3)17-18(23(4,5)6)27(24(7,8)9)16(20(29)32-14)15(19(28)31-13)26(17,27)21(30)33-25(10,11)12/h1-14H3
InChIKey WRAIQQLFTWVADQ-UHFFFAOYSA-N
Mol Weight 462.6 g/mol
Molecular Formula C27H42O6
Exact Mass 462.298139 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID Ktkw563F2Tu
Name 4,5,6-TRI-TERT.-BUTYLBICYCLO-[2.2.0]-HEXA-2,5-DIENE-1,2,3-TRICARBOXYLIC-ACID,1-TERT.-BUTYLESTER-2,3-DIMETHYLESTER
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C27H42O6
InChI InChI=1S/C27H42O6/c1-22(2,3)17-18(23(4,5)6)27(24(7,8)9)16(20(29)32-14)15(19(28)31-13)26(17,27)21(30)33-25(10,11)12/h1-14H3
InChIKey WRAIQQLFTWVADQ-UHFFFAOYSA-N
Literature Reference Author H.WINGERT,M.REGITZ
Literature Reference Citation CHEM.BER.,119,244(1986)
Literature Reference DOI 10.1002/cber.19861190122
Molecular Weight 462.627 g/mol
Solvent CDCl3
Source File Reference UWGB1595