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(E,1S)-1-[(1S,4aS,8aS)-5,5,8a-trimethyl-2-methylene-decalin-1-yl]-3-methylol-pent-2-ene-1,5-diol
SpectraBase Compound ID DKDXirGczLq
InChI InChI=1S/C20H34O3/c1-14-6-7-17-19(2,3)9-5-10-20(17,4)18(14)16(23)12-15(13-22)8-11-21/h12,16-18,21-23H,1,5-11,13H2,2-4H3/b15-12+/t16-,17-,18+,20-/m0/s1
InChIKey ZJRJKCCRIRYFON-BJRBBPMLSA-N
Mol Weight 322.5 g/mol
Molecular Formula C20H34O3
Exact Mass 322.250795 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID 7k69bmPxBng
Name (E,1S)-1-[(1S,4aS,8aS)-5,5,8a-trimethyl-2-methylene-decalin-1-yl]-3-methylol-pent-2-ene-1,5-diol
Compound Number 5
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C20H34O3
InChI InChI=1S/C20H34O3/c1-14-6-7-17-19(2,3)9-5-10-20(17,4)18(14)16(23)12-15(13-22)8-11-21/h12,16-18,21-23H,1,5-11,13H2,2-4H3/b15-12+/t16-,17-,18+,20-/m0/s1
InChIKey ZJRJKCCRIRYFON-BJRBBPMLSA-N
Literature Reference Author B.N.ZHOU,N.J.BAJ,T.E.GLASS,S.MALONE,M.C.M.WERKHOVEN,F.VANTRO ON,J.H.WISSE,D.G.I.K
Literature Reference Citation J.NAT.PROD.,60,1287(1997)
Literature Reference DOI 10.1021/np970233c
Molecular Weight 322.488 g/mol
Solvent CDCl3
Source File Reference UWRU330