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3-OXO-16-METHYL-FRIEDEL-16-ENE

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3-OXO-16-METHYL-FRIEDEL-16-ENE
SpectraBase Compound ID 4xWE7f3r0EP
InChI InChI=1S/C30H48O/c1-19-17-30(8)25-12-14-27(5)20(2)23(31)9-10-24(27)28(25,6)15-16-29(30,7)22-18-26(3,4)13-11-21(19)22/h20,22,24-25H,9-18H2,1-8H3/t20-,22+,24+,25-,27+,28-,29-,30+/m0/s1
InChIKey GVQWEJAFWNFDSY-PKSHBVOMSA-N
Mol Weight 424.7 g/mol
Molecular Formula C30H48O
Exact Mass 424.370516 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID K2GhJCLfz3u
Name 3-OXO-16-METHYL-FRIEDEL-16-ENE
Compound Number 7
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C30H48O
InChI InChI=1S/C30H48O/c1-19-17-30(8)25-12-14-27(5)20(2)23(31)9-10-24(27)28(25,6)15-16-29(30,7)22-18-26(3,4)13-11-21(19)22/h20,22,24-25H,9-18H2,1-8H3/t20-,22+,24+,25-,27+,28-,29-,30+/m0/s1
InChIKey GVQWEJAFWNFDSY-PKSHBVOMSA-N
Literature Reference Author L.P.DUARTE,R.R.S.DEMIRANDA,S.B.V.RODRIGUES,G.D.D.F.SILVA,S.A .V.FILHO,V.F.KNUPP
Literature Reference Citation MOLECULES,14,598(2009)
Literature Reference DOI 10.3390/molecules14020598
Molecular Weight 424.711 g/mol
Sample ID 69303
Solvent CDCl3