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[4-BETA,5-BETA-ETA(2)-[OS(NH3)5]-3-ALPHA-[2-TERT.-BUTYLDIMETHYLSILOXY)-2-PROPYL]-1-METHYL-3H-PYRROLIUM]-(OTF)3
SpectraBase Compound ID rVbbuoBigU
InChI InChI=1S/C14H28NOSi.3CHF3O3S.5H3N.Os/c1-12(10-13-8-9-15(5)11-13)16-17(6,7)14(2,3)4;3*2-1(3,4)8(5,6)7;;;;;;/h8-9,11-13H,10H2,1-7H3;3*(H,5,6,7);5*1H3;/q+1;;;;;;;;;+2/p-3/t12?,13-;;;;;;;;;/m1........./s1
InChIKey ZBRXESMVMYUMHN-GDCMLGSKSA-K
Mol Weight 977.05 g/mol
Molecular Formula C17H43F9N6O10OsS3Si
Exact Mass 978.144315 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID 4E4a0Un8dAP
Name [4-BETA,5-BETA-ETA(2)-[OS(NH3)5]-3-ALPHA-[2-TERT.-BUTYLDIMETHYLSILOXY)-2-PROPYL]-1-METHYL-3H-PYRROLIUM]-(OTF)3
Compound Number 19
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C17H43F9N6O10OsS3Si
InChI InChI=1S/C14H28NOSi.3CHF3O3S.5H3N.Os/c1-12(10-13-8-9-15(5)11-13)16-17(6,7)14(2,3)4;3*2-1(3,4)8(5,6)7;;;;;;/h8-9,11-13H,10H2,1-7H3;3*(H,5,6,7);5*1H3;/q+1;;;;;;;;;+2/p-3/t12?,13-;;;;;;;;;/m1........./s1
InChIKey ZBRXESMVMYUMHN-GDCMLGSKSA-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 977.014 g/mol
Solvent CD3CN
Source File Reference UWSP10249