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AOTYANQFKUPFBR-BFDHNVDPSA-N
SpectraBase Compound ID FCje4EtvCzO
InChI InChI=1S/C27H40O3/c1-19(2)9-7-14-26(5)15-8-10-24-23(26)12-11-20(3)27(24,6)17-25(30-21(4)28)22-13-16-29-18-22/h10,13,16,18,20,23,25H,1,7-9,11-12,14-15,17H2,2-6H3/t20-,23+,25+,26+,27+/m1/s1
InChIKey AOTYANQFKUPFBR-BFDHNVDPSA-N
Mol Weight 412.6 g/mol
Molecular Formula C27H40O3
Exact Mass 412.297745 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID KPM5MgGRMvA
Name AOTYANQFKUPFBR-BFDHNVDPSA-N
Compound Number 56
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C27H40O3
InChI InChI=1S/C27H40O3/c1-19(2)9-7-14-26(5)15-8-10-24-23(26)12-11-20(3)27(24,6)17-25(30-21(4)28)22-13-16-29-18-22/h10,13,16,18,20,23,25H,1,7-9,11-12,14-15,17H2,2-6H3/t20-,23+,25+,26+,27+/m1/s1
InChIKey AOTYANQFKUPFBR-BFDHNVDPSA-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 412.613 g/mol
Solvent CDCl3
Source File Reference UWSI22471