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Secoisolariciresinol
SpectraBase Compound ID 3QqeYCNtxH2
InChI InChI=1S/C23H30O6/c1-23(2)28-13-17(9-15-5-7-19(24)21(11-15)26-3)18(14-29-23)10-16-6-8-20(25)22(12-16)27-4/h5-8,11-12,17-18,24-25H,9-10,13-14H2,1-4H3
InChIKey YJHACFXKVFCHFP-UHFFFAOYSA-N
Mol Weight 402.49 g/mol
Molecular Formula C23H30O6
Exact Mass 402.204239 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID 5B5qhixOwJr
Name SECOISOLARICIRESINOL
Compound Number 14
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C23H30O6
InChI InChI=1S/C23H30O6/c1-23(2)28-13-17(9-15-5-7-19(24)21(11-15)26-3)18(14-29-23)10-16-6-8-20(25)22(12-16)27-4/h5-8,11-12,17-18,24-25H,9-10,13-14H2,1-4H3
InChIKey YJHACFXKVFCHFP-UHFFFAOYSA-N
Literature Reference Author S.J.YANG,J.M.FANG,Y.S.CHENG
Literature Reference Citation J.CHIN.CHEM.SOC.,46,811(1999)
Literature Reference DOI 10.1002/jccs.199900109
Molecular Weight 402.488 g/mol
Solvent CDCl3
Source File Reference UWMS5011