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3,4-SECO-FRIEDELAN-3,11-BETA-OLIDE
SpectraBase Compound ID FQuZdU3GA1W
InChI InChI=1S/C30H50O2/c1-9-26(4)13-12-21-28(6)17-16-27(5)15-14-25(2,3)18-22(27)29(28,7)19-23-30(21,8)20(26)10-11-24(31)32-23/h20-23H,9-19H2,1-8H3/t20-,21-,22-,23+,26+,27-,28-,29+,30+/m1/s1
InChIKey SJQQDEMBZRSKCT-HJVQXTMESA-N
Mol Weight 442.7 g/mol
Molecular Formula C30H50O2
Exact Mass 442.381081 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID 8d6HjjR5n6u
Name 3,4-SECO-FRIEDELAN-3,11-BETA-OLIDE
Compound Number 8
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C30H50O2
InChI InChI=1S/C30H50O2/c1-9-26(4)13-12-21-28(6)17-16-27(5)15-14-25(2,3)18-22(27)29(28,7)19-23-30(21,8)20(26)10-11-24(31)32-23/h20-23H,9-19H2,1-8H3/t20-,21-,22-,23+,26+,27-,28-,29+,30+/m1/s1
InChIKey SJQQDEMBZRSKCT-HJVQXTMESA-N
Literature Reference Author G.F.SOUSA,L.P.DUARTE,A.F.C.ALCANTARA,G.D.F.SILVA,S.A.VIEIRA- FILHO,R.R.SILVA,D.M.
Literature Reference Citation MOLECULES,17,13439(2012)
Literature Reference DOI 10.3390/molecules171113439
Molecular Weight 442.726 g/mol
Sample ID 1599
Solvent CDCl3