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ENT-15-OXO-KAUR-16-EN-18-OIC_ACID
SpectraBase Compound ID 9WNq7ucqOKq
InChI InChI=1S/C20H28O3/c1-12-13-5-6-15-18(2)8-4-9-19(3,17(22)23)14(18)7-10-20(15,11-13)16(12)21/h13-15H,1,4-11H2,2-3H3,(H,22,23)/t13-,14+,15+,18-,19+,20-/m1/s1
InChIKey WQBNGXOJBVBQKP-YBDDNXDTSA-N
Mol Weight 316.44 g/mol
Molecular Formula C20H28O3
Exact Mass 316.203845 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID 2oFsBnL6osu
Name ENT-15-OXO-KAUR-16-EN-18-OIC_ACID
Compound Number 3
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C20H28O3
InChI InChI=1S/C20H28O3/c1-12-13-5-6-15-18(2)8-4-9-19(3,17(22)23)14(18)7-10-20(15,11-13)16(12)21/h13-15H,1,4-11H2,2-3H3,(H,22,23)/t13-,14+,15+,18-,19+,20-/m1/s1
InChIKey WQBNGXOJBVBQKP-YBDDNXDTSA-N
Literature Reference Author H.S.SANTOS,F.W.A.BARROS,M.R.J.R.ALBUQUERQUE,P.N.BANDEIRA,C.P ESSOA,R.BRAZ-FILHO,F
Literature Reference Citation J.NAT.PROD.,72,1884(2009)
Literature Reference DOI 10.1021/np900250k
Molecular Weight 316.441 g/mol
Sample ID 33763
Solvent CDCl3