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REL-(7S,8S,8'R)-3',4'-DIMETHOXY-3,4-METHYLENEDIOXYLIGNAN-7-OL
SpectraBase Compound ID 6fh1LSs044C
InChI InChI=1S/C21H26O5/c1-13(9-15-5-7-17(23-3)19(10-15)24-4)14(2)21(22)16-6-8-18-20(11-16)26-12-25-18/h5-8,10-11,13-14,21-22H,9,12H2,1-4H3/t13-,14-,21+/m0/s1
InChIKey NJZFDQRQCKAWQT-DGCWBMGLSA-N
Mol Weight 358.43 g/mol
Molecular Formula C21H26O5
Exact Mass 358.178024 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID 4ohJWWJUke3
Name REL-(7S,8S,8'R)-3',4'-DIMETHOXY-3,4-METHYLENEDIOXYLIGNAN-7-OL
Compound Number 4
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C21H26O5
InChI InChI=1S/C21H26O5/c1-13(9-15-5-7-17(23-3)19(10-15)24-4)14(2)21(22)16-6-8-18-20(11-16)26-12-25-18/h5-8,10-11,13-14,21-22H,9,12H2,1-4H3/t13-,14-,21+/m0/s1
InChIKey NJZFDQRQCKAWQT-DGCWBMGLSA-N
Literature Reference Author J.C.MARTINEZ,R.TORRES
Literature Reference Citation PHYTOCHEM.,44,1179(1997)
Literature Reference DOI 10.1016/S0031-9422(96)00647-4
Molecular Weight 358.434 g/mol
Solvent CDCl3
Source File Reference UWPA447