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ERECTQUIONE-B;2,6-DIISOBUTYRYLOXY-3-GERANYL-5-ISOPRENYL-2,5-DIHEXADIENE-1,4-DIONE
SpectraBase Compound ID JOxuoheFXiu
InChI InChI=1S/C29H40O6/c1-17(2)11-10-12-21(9)14-16-23-24(30)22(15-13-18(3)4)26(34-28(32)19(5)6)25(31)27(23)35-29(33)20(7)8/h11,13-14,19-20H,10,12,15-16H2,1-9H3/b21-14+
InChIKey LLCTZEXRKYOVJM-KGENOOAVSA-N
Mol Weight 484.6 g/mol
Molecular Formula C29H40O6
Exact Mass 484.282489 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID L5C7R8VvqVQ
Name ERECTQUIONE-B;2,6-DIISOBUTYRYLOXY-3-GERANYL-5-ISOPRENYL-2,5-DIHEXADIENE-1,4-DIONE
Compound Number 2
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C29H40O6
InChI InChI=1S/C29H40O6/c1-17(2)11-10-12-21(9)14-16-23-24(30)22(15-13-18(3)4)26(34-28(32)19(5)6)25(31)27(23)35-29(33)20(7)8/h11,13-14,19-20H,10,12,15-16H2,1-9H3/b21-14+
InChIKey LLCTZEXRKYOVJM-KGENOOAVSA-N
Literature Reference Author T.Y.AN,M.D.SHAN,L.H.HU,S.J.LIU,Z.L.CHEN
Literature Reference Citation PHYTOCHEM.,59,395(2002)
Literature Reference DOI 10.1016/S0031-9422(01)00408-3
Molecular Weight 484.633 g/mol
Solvent CDCl3
Source File Reference UWVN2621