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[4,5-ETA(2)-[OS(NH3)5]-3-(3-OXO-TRANS-1-BUTENYL)-PYRROLE]-(OTF)2
SpectraBase Compound ID K6oTb2uod6B
InChI InChI=1S/C8H9NO.2CHF3O3S.5H3N.Os/c1-7(10)2-3-8-4-5-9-6-8;2*2-1(3,4)8(5,6)7;;;;;;/h2-6,9H,1H3;2*(H,5,6,7);5*1H3;/q;;;;;;;;+2/p-2/b3-2+;;;;;;;;
InChIKey MDABCUDHDOKZDX-FWMGCKHXSA-L
Mol Weight 708.68 g/mol
Molecular Formula C10H24F6N6O7OsS2
Exact Mass 710.066688 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID FlyEfUciyKD
Name [4,5-ETA(2)-[OS(NH3)5]-3-(3-OXO-TRANS-1-BUTENYL)-PYRROLE]-(OTF)2
Compound Number 36
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C10H24F6N6O7OsS2
InChI InChI=1S/C8H9NO.2CHF3O3S.5H3N.Os/c1-7(10)2-3-8-4-5-9-6-8;2*2-1(3,4)8(5,6)7;;;;;;/h2-6,9H,1H3;2*(H,5,6,7);5*1H3;/q;;;;;;;;+2/p-2/b3-2+;;;;;;;;
InChIKey MDABCUDHDOKZDX-FWMGCKHXSA-L
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 708.647 g/mol
Solvent ACETONE-D6
Source File Reference UWSP10231