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Colupulone

View entire compound with spectra: 3 NMR, and 1 MS (GC)

Colupulone
SpectraBase Compound ID D3VmXR1U481
InChI InChI=1S/C25H36O4/c1-15(2)9-10-19-22(27)20(21(26)18(7)8)24(29)25(23(19)28,13-11-16(3)4)14-12-17(5)6/h9,11-12,18,27-28H,10,13-14H2,1-8H3
InChIKey UNCDMWKTFLUPHZ-UHFFFAOYSA-N
Mol Weight 400.6 g/mol
Molecular Formula C25H36O4
Exact Mass 400.26136 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID EZ1pdP1PFZD
Name COLUPULONE
Compound Number 22
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C25H36O4
InChI InChI=1S/C25H36O4/c1-15(2)9-10-19-22(27)20(21(26)18(7)8)24(29)25(23(19)28,13-11-16(3)4)14-12-17(5)6/h9,11-12,18,27-28H,10,13-14H2,1-8H3
InChIKey UNCDMWKTFLUPHZ-UHFFFAOYSA-N
Literature Reference Author .INTELMANN,G.HASELEU,T.HOFMANN
Literature Reference Citation J.AGR.FOOD.CHEM.,57,1172(2009)
Literature Reference DOI 10.1021/jf803040g
Molecular Weight 400.558 g/mol
Sample ID 67927
Solvent CD3OD