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NELUMOL-D;4-O-[(2E,5E)-3,7-DIMETHYL-5-ETHOXY-2,5-OCTADIEN-7-OL]-SINAPYL-ALCOHOL
SpectraBase Compound ID JeAK7dChGJy
InChI InChI=1S/C23H34O6/c1-7-28-19(16-23(3,4)25)13-17(2)10-12-29-22-20(26-5)14-18(9-8-11-24)15-21(22)27-6/h8-10,14-16,24-25H,7,11-13H2,1-6H3/b9-8+,17-10+,19-16-
InChIKey WEYUEBJEXMHHGK-KCLPQUSMSA-N
Mol Weight 406.5 g/mol
Molecular Formula C23H34O6
Exact Mass 406.235539 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID IezgOSoJebs
Name NELUMOL-D;4-O-[(2E,5E)-3,7-DIMETHYL-5-ETHOXY-2,5-OCTADIEN-7-OL]-SINAPYL-ALCOHOL
Compound Number 3
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C23H34O6
InChI InChI=1S/C23H34O6/c1-7-28-19(16-23(3,4)25)13-17(2)10-12-29-22-20(26-5)14-18(9-8-11-24)15-21(22)27-6/h8-10,14-16,24-25H,7,11-13H2,1-6H3/b9-8+,17-10+,19-16-
InChIKey WEYUEBJEXMHHGK-KCLPQUSMSA-N
Literature Reference Author Y.ZHAO,X.HAO,W.LU,J.CAI,H.YU,T.SEVENET,F.GUERITTE
Literature Reference Citation J.NAT.PROD.,65,902(2002)
Literature Reference DOI 10.1021/np0200257
Molecular Weight 406.519 g/mol
Solvent CDCl3
Source File Reference UWSI6080