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5,5'-(PENTACYCLO-[5.3.0.0(2,6).0(4,10).0(5,8)]-DECANE-3'',9''-DIYLIDENE)-BIS-(2,2-DIMETHYL-1,3-DIOXAN-4,6-DIONE)
SpectraBase Compound ID 1qSMehW5wti
InChI InChI=1S/C22H20O8/c1-21(2)27-17(23)15(18(24)28-21)13-9-5-6-7(9)12-11(13)8(5)10(6)14(12)16-19(25)29-22(3,4)30-20(16)26/h5-12H,1-4H3/t5-,6-,7-,8-,9+,10+,11-,12-/m1/s1
InChIKey HGJQOXALDHRAOO-TWOHWVPZSA-N
Mol Weight 412.39 g/mol
Molecular Formula C22H20O8
Exact Mass 412.115818 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID 6Sizb2JRE5r
Name 5,5'-(PENTACYCLO-[5.3.0.0(2,6).0(4,10).0(5,8)]-DECANE-3'',9''-DIYLIDENE)-BIS-(2,2-DIMETHYL-1,3-DIOXAN-4,6-DIONE)
Compound Number 27
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C22H20O8
InChI InChI=1S/C22H20O8/c1-21(2)27-17(23)15(18(24)28-21)13-9-5-6-7(9)12-11(13)8(5)10(6)14(12)16-19(25)29-22(3,4)30-20(16)26/h5-12H,1-4H3/t5-,6-,7-,8-,9+,10+,11-,12-/m1/s1
InChIKey HGJQOXALDHRAOO-TWOHWVPZSA-N
Literature Reference Author R.F.C.BROWN,N.R.BROWNE,K.J.COULSTON,F.W.EASTWOOD,M.J.IRVINE, A.D.E.PULLIN,U.E.WIE
Literature Reference Citation AUSTR.J.CHEM.,42,1321(1989)
Literature Reference DOI 10.1071/ch9891321
Molecular Weight 412.396 g/mol
Solvent CDCl3