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(5-E,8-Z,14-Z)-6-IODOICOSA-5,8,14,19-TETRAEN-11-YNOIC_ACID
SpectraBase Compound ID 8PzR50QVO1p
InChI InChI=1S/C20H27IO2/c1-2-3-4-5-6-7-8-9-10-11-12-13-16-19(21)17-14-15-18-20(22)23/h2,6-7,12-13,17H,1,3-5,8,11,14-16,18H2,(H,22,23)/b7-6-,13-12-,19-17+
InChIKey XDGFOTMWSYQHDZ-WTRZDSATSA-N
Mol Weight 426.34 g/mol
Molecular Formula C20H27IO2
Exact Mass 426.105575 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID HHVwVGKfi4X
Name (5-E,8-Z,14-Z)-6-IODOICOSA-5,8,14,19-TETRAEN-11-YNOIC_ACID
Compound Number 3
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C20H27IO2
InChI InChI=1S/C20H27IO2/c1-2-3-4-5-6-7-8-9-10-11-12-13-16-19(21)17-14-15-18-20(22)23/h2,6-7,12-13,17H,1,3-5,8,11,14-16,18H2,(H,22,23)/b7-6-,13-12-,19-17+
InChIKey XDGFOTMWSYQHDZ-WTRZDSATSA-N
Literature Reference Author B.S.HWANG,K.LEE,C.YANG,E.J.JEONG,J.R.RHO
Literature Reference Citation J.NAT.PROD.,76,2355(2013)
Literature Reference DOI 10.1021/np400793r
Molecular Weight 426.338 g/mol
Solvent CDCl3
Source File Reference UWMZ43643