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(5S*,6S*,7R*,8S*,10S*)-1-OXO-5-ACETOXY-3,10-EPOXY-8-METHACRYLOXY-2,4(15),11(13)-GERMACRATRIEN-6,12-OLIDE
SpectraBase Compound ID Dobz1TUpqtD
InChI InChI=1S/C21H22O8/c1-9(2)19(24)27-14-8-21(6)15(23)7-13(29-21)10(3)17(26-12(5)22)18-16(14)11(4)20(25)28-18/h7,14,16-18H,1,3-4,8H2,2,5-6H3/t14-,16-,17+,18+,21-/m1/s1
InChIKey IRUMFIYLPWXHOF-PKQISHPWSA-N
Mol Weight 402.4 g/mol
Molecular Formula C21H22O8
Exact Mass 402.131468 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID DGAl1ChXNKF
Name (5S*,6S*,7R*,8S*,10S*)-1-OXO-5-ACETOXY-3,10-EPOXY-8-METHACRYLOXY-2,4(15),11(13)-GERMACRATRIEN-6,12-OLIDE
Compound Number 2B
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C21H22O8
InChI InChI=1S/C21H22O8/c1-9(2)19(24)27-14-8-21(6)15(23)7-13(29-21)10(3)17(26-12(5)22)18-16(14)11(4)20(25)28-18/h7,14,16-18H,1,3-4,8H2,2,5-6H3/t14-,16-,17+,18+,21-/m1/s1
InChIKey IRUMFIYLPWXHOF-PKQISHPWSA-N
Literature Reference Author M.A.LUNARDELLO,J.C.TOMAZ,W.VICHNEWSKI,J.L.C.LOPES,A.B.GUTIER REZ,J.G.DIAZ,W.HERZ
Literature Reference Citation J.BRAZ.CHEM.SOC.,6,307(1995)
Literature Reference DOI 10.5935/0103-5053.19950051
Molecular Weight 402.401 g/mol
Solvent CDCl3
Source File Reference UWLU5656