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[4,5-ETA(2)-[OS(NH3)5]-1,1-DIMETHYL-2-PYRROLINIUM]-(OTF)3
SpectraBase Compound ID Ae4opnOtZNs
InChI InChI=1S/C6H12N.3CHF3O3S.5H3N.Os/c1-7(2)5-3-4-6-7;3*2-1(3,4)8(5,6)7;;;;;;/h3,5H,4,6H2,1-2H3;3*(H,5,6,7);5*1H3;/q+1;;;;;;;;;+2/p-3
InChIKey VNQXDBZOCNHNLO-UHFFFAOYSA-K
Mol Weight 820.7 g/mol
Molecular Formula C9H27F9N6O9OsS3
Exact Mass 822.047273 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID 1Fc4U7q7YKj
Name [4,5-ETA(2)-[OS(NH3)5]-1,1-DIMETHYL-2-PYRROLINIUM]-(OTF)3
Compound Number 50
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C9H27F9N6O9OsS3
InChI InChI=1S/C6H12N.3CHF3O3S.5H3N.Os/c1-7(2)5-3-4-6-7;3*2-1(3,4)8(5,6)7;;;;;;/h3,5H,4,6H2,1-2H3;3*(H,5,6,7);5*1H3;/q+1;;;;;;;;;+2/p-3
InChIKey VNQXDBZOCNHNLO-UHFFFAOYSA-K
Literature Reference Author L.M.HODGES,J.GONZALEZ,J.I.KOONTZ,W.H.MYERS,W.D.HARMAN
Literature Reference Citation J.ORG.CHEM.,60,2125(1995)
Literature Reference DOI 10.1021/jo00112a037
Molecular Weight 820.714 g/mol
Solvent CD3CN:DMSO-D6=95:5
Source File Reference UWSP10268