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VXAPUYRRCZPZDB-SEJKWVFYSA-N
SpectraBase Compound ID 7bYZFOXQsPw
InChI InChI=1S/C21H30O3/c1-17(2)8-5-12-20(21(22)23-4)13-7-10-18(3)9-6-11-19-14-15-24-16-19/h8-9,13-16H,5-7,10-12H2,1-4H3/b18-9+,20-13+
InChIKey VXAPUYRRCZPZDB-SEJKWVFYSA-N
Mol Weight 330.47 g/mol
Molecular Formula C21H30O3
Exact Mass 330.219495 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID 9phSSXOMCGd
Name (2E,6E)-9-(3-FURYL)-6-METHYL-2-(4-METHYLPENT-3-ENYL)-NONA-2,6-DIEN-METHYLESTER
Compound Number 3A
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C21H30O3
InChI InChI=1S/C21H30O3/c1-17(2)8-5-12-20(21(22)23-4)13-7-10-18(3)9-6-11-19-14-15-24-16-19/h8-9,13-16H,5-7,10-12H2,1-4H3/b18-9+,20-13+
InChIKey VXAPUYRRCZPZDB-SEJKWVFYSA-N
Literature Reference Author M.J.SIMIRGIOTIS,L.S.FAVIER,P.C.ROSSOMANDO,O.S.GIORDANO,C.E.T ONN,J.I.PADRON,J.T.V
Literature Reference Citation PHYTOCHEM.,55,721(2000)
Literature Reference DOI 10.1016/S0031-9422(00)00290-9
Molecular Weight 330.467 g/mol
Solvent CDCl3
Source File Reference UWLU2582