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OZONIDE-OF-2,3-DIMETHYL-(1-ALPHA,6-ALPHA,2-BETA,5-BETA)-12-OXATRICYCLO-[4.4.1.1(2,5)]-DODEC-3-EN-11-ONE
SpectraBase Compound ID FdN7YPtRprq
InChI InChI=1S/C13H18O5/c1-12-8-6-4-3-5-7(9(8)14)10(15-12)11-16-13(12,2)18-17-11/h7-8,10-11H,3-6H2,1-2H3/t7-,8+,10-,11-,12+,13+/m1/s1
InChIKey SWMAQRCDUGLRIL-IDVBIJSJSA-N
Mol Weight 254.28 g/mol
Molecular Formula C13H18O5
Exact Mass 254.115424 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID 4KJgzM6vR45
Name OZONIDE-OF-2,3-DIMETHYL-(1-ALPHA,6-ALPHA,2-BETA,5-BETA)-12-OXATRICYCLO-[4.4.1.1(2,5)]-DODEC-3-EN-11-ONE
Compound Number 18
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C13H18O5
InChI InChI=1S/C13H18O5/c1-12-8-6-4-3-5-7(9(8)14)10(15-12)11-16-13(12,2)18-17-11/h7-8,10-11H,3-6H2,1-2H3/t7-,8+,10-,11-,12+,13+/m1/s1
InChIKey SWMAQRCDUGLRIL-IDVBIJSJSA-N
Literature Reference Author L.C.A.BARBOSA,C.R.A.MALTHA,R.C.CUSATI,R.R.TEIXEIRA,F.F.RODRI GUES,A.A.SILVA,M.G.B
Literature Reference Citation J.AGR.FOOD.CHEM.,57,10107(2009)
Literature Reference DOI 10.1021/jf902540z
Molecular Weight 254.283 g/mol
Sample ID 68216
Solvent CDCl3