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EMPETRIKARINEN_B;1-[5,7-DIHYDROXY-2-METHYL-2-(4-METHYLPENT-3-ENYL)-CHROMEN-8-YL]-2-METHYLBUTAN-1-ONE
SpectraBase Compound ID CTL185JXjJM
InChI InChI=1S/C21H28O4/c1-6-14(4)19(24)18-17(23)12-16(22)15-9-11-21(5,25-20(15)18)10-7-8-13(2)3/h8-9,11-12,14,22-23H,6-7,10H2,1-5H3
InChIKey UAJYKGPSRWOQCL-UHFFFAOYSA-N
Mol Weight 344.45 g/mol
Molecular Formula C21H28O4
Exact Mass 344.198759 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID 84T3mmjkxfj
Name EMPETRIKARINEN_B;1-[5,7-DIHYDROXY-2-METHYL-2-(4-METHYLPENT-3-ENYL)-CHROMEN-8-YL]-2-METHYLBUTAN-1-ONE
Compound Number 2
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C21H28O4
InChI InChI=1S/C21H28O4/c1-6-14(4)19(24)18-17(23)12-16(22)15-9-11-21(5,25-20(15)18)10-7-8-13(2)3/h8-9,11-12,14,22-23H,6-7,10H2,1-5H3
InChIKey UAJYKGPSRWOQCL-UHFFFAOYSA-N
Literature Reference Author S.SCHMIDT,G.JUERGENLIEMK,T.J.SCHMIDT,H.SKALTSA,J.HEILMANN
Literature Reference Citation J.NAT.PROD.,75,1697(2012)
Literature Reference DOI 10.1021/np300237n
Molecular Weight 344.451 g/mol
Sample ID 41488
Solvent CDCl3