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4-(1,7-DIOXASPIRA-[5.5]-UNDEC-4-EN-2-YL)-BUTAN-2-ONE
SpectraBase Compound ID 6h3eQd7mh5p
InChI InChI=1S/C13H20O3/c1-11(14)6-7-12-5-4-9-13(16-12)8-2-3-10-15-13/h4,9,12H,2-3,5-8,10H2,1H3
InChIKey LCOYFVQARRGWSW-UHFFFAOYSA-N
Mol Weight 224.3 g/mol
Molecular Formula C13H20O3
Exact Mass 224.141245 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID CzicsDMTOI4
Name 4-(1,7-DIOXASPIRA-[5.5]-UNDEC-4-EN-2-YL)-BUTAN-2-ONE
Compound Number 25
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C13H20O3
InChI InChI=1S/C13H20O3/c1-11(14)6-7-12-5-4-9-13(16-12)8-2-3-10-15-13/h4,9,12H,2-3,5-8,10H2,1H3
InChIKey LCOYFVQARRGWSW-UHFFFAOYSA-N
Literature Reference Author P.R.ALLEN,M.A.BRIMBLE,F.A.FARES
Literature Reference Citation J.CHEM.SOC.PERKIN-1,2403(1998)
Literature Reference DOI 10.1039/a802490a
Molecular Weight 224.300 g/mol
Solvent CDCl3
Source File Reference UWCP9171