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EMPETRIFRANZINAN_C;1-(1,9-EPOXY-3-HYDROXY-6,6,9-TRIMETHYL-6A,7,8,9,10,10A-HEXAHYDRO-6-H-BENZO-[C]-CHROMENE-4-YL)-2-METHYLBUTAN-1-ONE
SpectraBase Compound ID DYCdrHKztnY
InChI InChI=1S/C21H28O4/c1-6-11(2)18(23)17-14(22)9-15-16-12-10-21(5,24-15)8-7-13(12)20(3,4)25-19(16)17/h9,11-13,22H,6-8,10H2,1-5H3/t11?,12-,13+,21-/m1/s1
InChIKey FUOLYAMVOGPERE-FMYDICDESA-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 JKedXDgllDZ
Name EMPETRIFRANZINAN_C;1-(1,9-EPOXY-3-HYDROXY-6,6,9-TRIMETHYL-6A,7,8,9,10,10A-HEXAHYDRO-6-H-BENZO-[C]-CHROMENE-4-YL)-2-METHYLBUTAN-1-ONE
Compound Number 14
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C21H28O4
InChI InChI=1S/C21H28O4/c1-6-11(2)18(23)17-14(22)9-15-16-12-10-21(5,24-15)8-7-13(12)20(3,4)25-19(16)17/h9,11-13,22H,6-8,10H2,1-5H3/t11?,12-,13+,21-/m1/s1
InChIKey FUOLYAMVOGPERE-FMYDICDESA-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 41499
Solvent CDCl3