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HEXAACETOXYTRIQUINANE;ALL-EXO-2,3,5,6,8,9-HEXAACETOXYTRICYCLO-[5.2.1.0(4,10)]-DECANE
SpectraBase Compound ID 2SyIzbChjr7
InChI InChI=1S/C22H28O12/c1-7(23)29-17-14-13-15(18(17)30-8(2)24)20(32-10(4)26)22(34-12(6)28)16(13)21(33-11(5)27)19(14)31-9(3)25/h13-22H,1-6H3/t13?,14?,15?,16?,17-,18+,19+,20-,21-,22+
InChIKey LCCYNJWLEHFVNM-FEGBXGAYSA-N
Mol Weight 484.45 g/mol
Molecular Formula C22H28O12
Exact Mass 484.158076 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID IX7Vc8NUFPA
Name HEXAACETOXYTRIQUINANE;ALL-EXO-2,3,5,6,8,9-HEXAACETOXYTRICYCLO-[5.2.1.0(4,10)]-DECANE
Compound Number 9
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C22H28O12
InChI InChI=1S/C22H28O12/c1-7(23)29-17-14-13-15(18(17)30-8(2)24)20(32-10(4)26)22(34-12(6)28)16(13)21(33-11(5)27)19(14)31-9(3)25/h13-22H,1-6H3/t13?,14?,15?,16?,17-,18+,19+,20-,21-,22+
InChIKey LCCYNJWLEHFVNM-FEGBXGAYSA-N
Literature Reference Author R.HAAG,R.ZUBER,S.DONON,C.H.LEE,M.NOLTEMEYER,K.JOHNSEN,A.D.ME IJERE
Literature Reference Citation J.ORG.CHEM.,63,2544(1998)
Literature Reference DOI 10.1021/jo971796w
Molecular Weight 484.457 g/mol
Sample ID 36998
Solvent CDCl3