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(5S,8R,9R,10S,13S)-METHYL-2-OXO-3-CLERODEN-15-OATE
SpectraBase Compound ID 5J3cJ0zARcf
InChI InChI=1S/C21H34O3/c1-14(11-19(23)24-6)7-9-20(4)15(2)8-10-21(5)16(3)12-17(22)13-18(20)21/h12,14-15,18H,7-11,13H2,1-6H3/t14-,15+,18-,20+,21+/m0/s1
InChIKey GTRRAFRWVKQVAX-JNSMLDBWSA-N
Mol Weight 334.5 g/mol
Molecular Formula C21H34O3
Exact Mass 334.250795 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID HttvQyMFyaf
Name (5S,8R,9R,10S,13S)-METHYL-2-OXO-3-CLERODEN-15-OATE
Compound Number 1
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C21H34O3
InChI InChI=1S/C21H34O3/c1-14(11-19(23)24-6)7-9-20(4)15(2)8-10-21(5)16(3)12-17(22)13-18(20)21/h12,14-15,18H,7-11,13H2,1-6H3/t14-,15+,18-,20+,21+/m0/s1
InChIKey GTRRAFRWVKQVAX-JNSMLDBWSA-N
Literature Reference Author J.G.URONES,P.BASABE,I.S.MARCOS,D.D.MARTIN,V.JIMENEZ,M.J.SEXM ERO,B.GOMEZ,A.M.Z.S
Literature Reference Citation PHYTOCHEM.,30,3471(1991)
Literature Reference DOI 10.1016/0031-9422(91)83235-D
Molecular Weight 334.499 g/mol
Solvent CDCl3
Source File Reference UWMS26535