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(E)-2,11,12,13,15,16-HEXACHLORO-14-HYDROXYTETRACOS-1-EN-1-YL-SULFATE
SpectraBase Compound ID CH3FxUlh8zn
InChI InChI=1S/C24H42Cl6O5S/c1-2-3-4-5-9-13-16-20(27)22(29)24(31)23(30)21(28)19(26)15-12-10-7-6-8-11-14-18(25)17-35-36(32,33)34/h17,19-24,31H,2-16H2,1H3,(H,32,33,34)/p-1/b18-17+
InChIKey ACRMTHSZHIGDGF-ISLYRVAYSA-M
Mol Weight 654.4 g/mol
Molecular Formula C24H41Cl6O5S
Exact Mass 651.080587 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID 6STrk7i5jWX
Name (E)-2,11,12,13,15,16-HEXACHLORO-14-HYDROXYTETRACOS-1-EN-1-YL-SULFATE
Compound Number 1
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C24H41Cl6O5S
InChI InChI=1S/C24H42Cl6O5S/c1-2-3-4-5-9-13-16-20(27)22(29)24(31)23(30)21(28)19(26)15-12-10-7-6-8-11-14-18(25)17-35-36(32,33)34/h17,19-24,31H,2-16H2,1H3,(H,32,33,34)/p-1/b18-17+
InChIKey ACRMTHSZHIGDGF-ISLYRVAYSA-M
Literature Reference Author A.R.PEREIRA,T.BYRUM,G.M.SHIBUYA,C.D.VANDERWAL,W.H.GERWICK
Literature Reference Citation J.NAT.PROD.,73,279(2010)
Literature Reference DOI 10.1021/np900672h
Molecular Weight 654.365 g/mol
Sample ID 35028
Solvent CD3OD