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IFICGHBDUBJMML-BIYVYPRRSA-N
SpectraBase Compound ID HWLxkXNi1mb
InChI InChI=1S/C27H42O4/c1-19(10-8-12-21(3)14-16-25(29)27(5,6)31)9-7-11-20(2)13-15-23-18-24(28)17-22(4)26(23)30/h9,12-13,17-18,25,28-31H,7-8,10-11,14-16H2,1-6H3/b19-9+,20-13+,21-12+/t25-/m0/s1
InChIKey IFICGHBDUBJMML-BIYVYPRRSA-N
Mol Weight 430.6 g/mol
Molecular Formula C27H42O4
Exact Mass 430.30831 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID 39bZSkbMBud
Name IFICGHBDUBJMML-BIYVYPRRSA-N
Compound Number 5
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C27H42O4
InChI InChI=1S/C27H42O4/c1-19(10-8-12-21(3)14-16-25(29)27(5,6)31)9-7-11-20(2)13-15-23-18-24(28)17-22(4)26(23)30/h9,12-13,17-18,25,28-31H,7-8,10-11,14-16H2,1-6H3/b19-9+,20-13+,21-12+/t25-/m0/s1
InChIKey IFICGHBDUBJMML-BIYVYPRRSA-N
Literature Reference Author J.MORI,M.IWASHIMA,H.WAKASUGI,H.SAITO,T.MATSUNAGA,M.OGASAWARA ,S.TAKAHASHI,H.SUZUK
Literature Reference Citation CHEM.PHARM.BULL.,53,1159(2005)
Literature Reference DOI 10.1248/cpb.53.1159
Molecular Weight 430.628 g/mol
Sample ID 54112
Solvent CDCl3