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(3,4-Methylenedioxy-7-oxo-1'-allyl-3',5'-dimethoxy)-[8.0.4']-Neolignan
SpectraBase Compound ID KxHLbWlHnkP
InChI InChI=1S/C21H22O6/c1-5-6-14-9-18(23-3)21(19(10-14)24-4)27-13(2)20(22)15-7-8-16-17(11-15)26-12-25-16/h5,7-11,13H,1,6,12H2,2-4H3
InChIKey LQRBTWQJHFMZFE-UHFFFAOYSA-N
Mol Weight 370.4 g/mol
Molecular Formula C21H22O6
Exact Mass 370.141638 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID CuojOu7WmAX
Name (3,4-METHYLENEDIOXY-7-OXO-1'-ALLYL-3',5'-DIMETHOXY)-8.0.4'-NEOLIGNAN
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C21H22O6
InChI InChI=1S/C21H22O6/c1-5-6-14-9-18(23-3)21(19(10-14)24-4)27-13(2)20(22)15-7-8-16-17(11-15)26-12-25-16/h5,7-11,13H,1,6,12H2,2-4H3
InChIKey LQRBTWQJHFMZFE-UHFFFAOYSA-N
Literature Reference Author S.A.ZACCHINO,H.BADANO
Literature Reference Citation J.NAT.PROD.,54,155(1991)
Literature Reference DOI 10.1021/np50073a013
Molecular Weight 370.402 g/mol
Solvent CDCl3
Source File Reference UWTS61