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1,5,9-O-TRIACETYL-AGERATRIOL
SpectraBase Compound ID BNyWz3O03uZ
InChI InChI=1S/C21H30O6/c1-12(2)18-10-20(26-16(6)23)13(3)8-9-19(25-15(5)22)14(4)21(11-18)27-17(7)24/h18-21H,1,3-4,8-11H2,2,5-7H3/t18?,19-,20-,21+/m0/s1
InChIKey LJPRBLOVNLOEQX-ASJDWODUSA-N
Mol Weight 378.47 g/mol
Molecular Formula C21H30O6
Exact Mass 378.204239 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID 5MBsUZliWP
Name 1,5,9-O-TRIACETYL-AGERATRIOL
Compound Number 1D
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C21H30O6
InChI InChI=1S/C21H30O6/c1-12(2)18-10-20(26-16(6)23)13(3)8-9-19(25-15(5)22)14(4)21(11-18)27-17(7)24/h18-21H,1,3-4,8-11H2,2,5-7H3/t18?,19-,20-,21+/m0/s1
InChIKey LJPRBLOVNLOEQX-ASJDWODUSA-N
Literature Reference Author A.KIJJOA,L.M.VIEIRA,J.A.PEREIRA,A.M.S.SILVA,W.HERZ
Literature Reference Citation PHYTOCHEM.,51,555(1999)
Literature Reference DOI 10.1016/S0031-9422(99)00054-0
Molecular Weight 378.466 g/mol
Solvent CDCl3
Source File Reference UWUC386