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OZONIDE-OF-2-METHYL-(1-ALPHA,6-ALPHA,2-BETA,5-BETA)-12-OXATRICYCLO-[4.4.1.1(2,5)]-DODEC-3-EN-11-ONE
SpectraBase Compound ID CzuOkWtfUnn
InChI InChI=1S/C12H16O5/c1-12-7-5-3-2-4-6(8(7)13)9(15-12)10-14-11(12)17-16-10/h6-7,9-11H,2-5H2,1H3/t6-,7+,9-,10-,11+,12+/m1/s1
InChIKey LZSYCIAQNKNIQO-AALSQDSQSA-N
Mol Weight 240.25 g/mol
Molecular Formula C12H16O5
Exact Mass 240.099774 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID 3tlgto9fjm
Name OZONIDE-OF-2-METHYL-(1-ALPHA,6-ALPHA,2-BETA,5-BETA)-12-OXATRICYCLO-[4.4.1.1(2,5)]-DODEC-3-EN-11-ONE
Compound Number 16
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C12H16O5
InChI InChI=1S/C12H16O5/c1-12-7-5-3-2-4-6(8(7)13)9(15-12)10-14-11(12)17-16-10/h6-7,9-11H,2-5H2,1H3/t6-,7+,9-,10-,11+,12+/m1/s1
InChIKey LZSYCIAQNKNIQO-AALSQDSQSA-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 240.256 g/mol
Sample ID 68215
Solvent CDCl3