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(E)-8-OXO-9-OCTADECENOIC-ACID-ETHYLESTER
SpectraBase Compound ID 85gduilBw2Q
InChI InChI=1S/C20H36O3/c1-3-5-6-7-8-9-10-13-16-19(21)17-14-11-12-15-18-20(22)23-4-2/h13,16H,3-12,14-15,17-18H2,1-2H3/b16-13+
InChIKey KQGOGACAZUWACN-DTQAZKPQSA-N
Mol Weight 324.5 g/mol
Molecular Formula C20H36O3
Exact Mass 324.266445 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID IOU8pLrCXnF
Name (E)-8-OXO-9-OCTADECENOIC-ACID-ETHYLESTER
Compound Number 2
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C20H36O3
InChI InChI=1S/C20H36O3/c1-3-5-6-7-8-9-10-13-16-19(21)17-14-11-12-15-18-20(22)23-4-2/h13,16H,3-12,14-15,17-18H2,1-2H3/b16-13+
InChIKey KQGOGACAZUWACN-DTQAZKPQSA-N
Literature Reference Author H.KAWAGISHI,T.MIYAZAWA,H.KUME,Y.ARIMOTO,T.INAKUMA
Literature Reference Citation J.NAT.PROD.,65,1712(2002)
Literature Reference DOI 10.1021/np020200j
Molecular Weight 324.504 g/mol
Solvent CDCl3
Source File Reference UWSI7293