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TOPSENTOLIDE_A2
SpectraBase Compound ID EuUqCsK964O
InChI InChI=1S/C20H30O3/c1-2-3-4-5-6-10-13-18-19(23-18)16-15-17-12-9-7-8-11-14-20(21)22-17/h6-7,9-10,15-19H,2-5,8,11-14H2,1H3/b9-7-,10-6-,16-15+/t17-,18-,19+/m0/s1
InChIKey MWTCCFSVIGUOIH-AYUWUTFTSA-N
Mol Weight 318.46 g/mol
Molecular Formula C20H30O3
Exact Mass 318.219495 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID 9Wk0DAJiaLy
Name TOPSENTOLIDE_A2
Compound Number 2
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C20H30O3
InChI InChI=1S/C20H30O3/c1-2-3-4-5-6-10-13-18-19(23-18)16-15-17-12-9-7-8-11-14-20(21)22-17/h6-7,9-10,15-19H,2-5,8,11-14H2,1H3/b9-7-,10-6-,16-15+/t17-,18-,19+/m0/s1
InChIKey MWTCCFSVIGUOIH-AYUWUTFTSA-N
Literature Reference Author X.LUO,F.LI,J.HONG,C.O.LEE,C.J.SIM,K.S.IM,J.H.JUNG
Literature Reference Citation J.NAT.PROD.,69,567(2006)
Literature Reference DOI 10.1021/np0503552
Molecular Weight 318.456 g/mol
Solvent CD3OD
Source File Reference UWMZ18176