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20,22-EPOXY-2,10,19,21-CLADOCORATETRAEN-18-ONE
SpectraBase Compound ID D8q6DXj77PK
InChI InChI=1S/C25H36O2/c1-18(2)8-6-13-24(4)14-7-9-22-21(24)11-10-19(3)25(22,5)16-23(26)20-12-15-27-17-20/h9,12,15,17,19,21H,1,6-8,10-11,13-14,16H2,2-5H3/t19-,21+,24+,25+/m1/s1
InChIKey NJRQRHDVDCADNN-BDBQITIBSA-N
Mol Weight 368.6 g/mol
Molecular Formula C25H36O2
Exact Mass 368.27153 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID 3I7TKWioFCJ
Name 20,22-EPOXY-2,10,19,21-CLADOCORATETRAEN-18-ONE
Compound Number 51
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C25H36O2
InChI InChI=1S/C25H36O2/c1-18(2)8-6-13-24(4)14-7-9-22-21(24)11-10-19(3)25(22,5)16-23(26)20-12-15-27-17-20/h9,12,15,17,19,21H,1,6-8,10-11,13-14,16H2,2-5H3/t19-,21+,24+,25+/m1/s1
InChIKey NJRQRHDVDCADNN-BDBQITIBSA-N
Literature Reference Author I.S.MARCOS,A.B.PEDRERO,M.J.SEXMERO,D.DIEZ,P.BASABE,N.GARCIA, R.F.MORO,H.B.BROUGHT
Literature Reference Citation J.ORG.CHEM.,68,7496(2003)
Literature Reference DOI 10.1021/jo034663l
Molecular Weight 368.560 g/mol
Solvent CDCl3
Source File Reference UWSI22459