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XQVVNUQPNCRRAK-NKYOLRSBSA-N
SpectraBase Compound ID IZRZA27AlL
InChI InChI=1S/C20H34O3/c1-17(2)10-13(21)11-18(3)16(17)8-15(22)14-7-12-9-20(14,18)6-5-19(12,4)23/h12-16,21-23H,5-11H2,1-4H3/t12-,13-,14+,15-,16-,18-,19-,20+/m0/s1
InChIKey XQVVNUQPNCRRAK-NKYOLRSBSA-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 3RvqOM3ni6V
Name 2-ALPHA,7-BETA,(13S)-TRIHYDROXYSTEMODANE
Compound Number 17
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C20H34O3
InChI InChI=1S/C20H34O3/c1-17(2)10-13(21)11-18(3)16(17)8-15(22)14-7-12-9-20(14,18)6-5-19(12,4)23/h12-16,21-23H,5-11H2,1-4H3/t12-,13-,14+,15-,16-,18-,19-,20+/m0/s1
InChIKey XQVVNUQPNCRRAK-NKYOLRSBSA-N
Literature Reference Author G.D.A.MARTIN,W.F.REYNOLDS,P.B.REESE
Literature Reference Citation PHYTOCHEM.,65,701(2004)
Literature Reference DOI 10.1016/j.phytochem.2004.01.011
Molecular Weight 322.488 g/mol
Solvent CD3OD
Source File Reference UWLU34632