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XFNIQTBKBLIVDE-HEELKZOISA-N
SpectraBase Compound ID HuoM2pLJJ72
InChI InChI=1S/C23H40O6/c1-8-18-10-9-12(2)19(24)17(7)23(27)14(4)11-13(3)21(29-23)15(5)20(25)16(6)22(26)28-18/h9,13-21,24-25,27H,8,10-11H2,1-7H3/b12-9+/t13-,14+,15-,16+,17+,18+,19-,20-,21+,23-/m0/s1
InChIKey XFNIQTBKBLIVDE-HEELKZOISA-N
Mol Weight 412.6 g/mol
Molecular Formula C23H40O6
Exact Mass 412.282489 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID BUqfHDAQhPg
Name XFNIQTBKBLIVDE-HEELKZOISA-N
Compound Number 35
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C23H40O6
InChI InChI=1S/C23H40O6/c1-8-18-10-9-12(2)19(24)17(7)23(27)14(4)11-13(3)21(29-23)15(5)20(25)16(6)22(26)28-18/h9,13-21,24-25,27H,8,10-11H2,1-7H3/b12-9+/t13-,14+,15-,16+,17+,18+,19-,20-,21+,23-/m0/s1
InChIKey XFNIQTBKBLIVDE-HEELKZOISA-N
Literature Reference Author K.KINOSHITA,P.G.WILLIARD,C.KHOSLA,D.E.CANE
Literature Reference Citation J.AM.CHEM.SOC.,123,2495(2001)
Literature Reference DOI 10.1021/ja004139l
Molecular Weight 412.567 g/mol
Solvent CD2Cl2
Source File Reference UWVN27868