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2,5-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 B3dwalM0Xi0
InChI InChI=1S/C13H18O2/c1-12-7-8-13(2,15-12)10-6-4-3-5-9(12)11(10)14/h7-10H,3-6H2,1-2H3/t9-,10+,12+,13-
InChIKey NKVVKLFUVVYMEY-QZHINBJYSA-N
Mol Weight 206.28 g/mol
Molecular Formula C13H18O2
Exact Mass 206.13068 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID H5gjojPGKZJ
Name 2,5-DIMETHYL-(1-ALPHA,6-ALPHA,2-BETA,5-BETA)-12-OXATRICYCLO-[4.4.1.1(2,5)]-DODEC-3-EN-11-ONE
Compound Number 13
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C13H18O2
InChI InChI=1S/C13H18O2/c1-12-7-8-13(2,15-12)10-6-4-3-5-9(12)11(10)14/h7-10H,3-6H2,1-2H3/t9-,10+,12+,13-
InChIKey NKVVKLFUVVYMEY-QZHINBJYSA-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 206.285 g/mol
Sample ID 68207
Solvent CDCl3