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5-(1,1-Dimethylprop-2-enyl)-2-(3-methylbut-2-enyl)cyclohexa-2,5-diene-1,4-dione
SpectraBase Compound ID CwAc7ksXoLM
InChI InChI=1S/C16H20O2/c1-6-16(4,5)13-10-14(17)12(9-15(13)18)8-7-11(2)3/h6-7,9-10H,1,8H2,2-5H3
InChIKey IXIJAOCIIZYSQJ-UHFFFAOYSA-N
Mol Weight 244.33 g/mol
Molecular Formula C16H20O2
Exact Mass 244.14633 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID ByRZ9UPRbeS
Name 5-(1,1-DIMETHYLPROP-2-ENYL)-2-(3-METHYLBUT-2-ENYL)-CYCLOHEXA-2,5-DIENE-1,4-DIONE
Compound Number 4
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C16H20O2
InChI InChI=1S/C16H20O2/c1-6-16(4,5)13-10-14(17)12(9-15(13)18)8-7-11(2)3/h6-7,9-10H,1,8H2,2-5H3
InChIKey IXIJAOCIIZYSQJ-UHFFFAOYSA-N
Literature Reference Author C.E.SANSOM,L.LARSEN,N.B.PERRY,M.V.BERRIDGE,E.W.CHIA,J.L.HARP ER,V.L.WEBB
Literature Reference Citation J.NAT.PROD.,70,2042(2007)
Literature Reference DOI 10.1021/np070436t
Molecular Weight 244.334 g/mol
Sample ID 31281
Solvent CDCl3