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1,5-DIPHOSPHONIATRICYCLO-[3.3.3.0]-UNDECANE-BIS-(TRIFLUOROMETHANESULFONATE)
SpectraBase Compound ID GTqb4DNi6DD
InChI InChI=1S/C9H18P2.2CHF3O3S/c1-4-10-6-2-7-11(10,5-1)9-3-8-10;2*2-1(3,4)8(5,6)7/h1-9H2;2*(H,5,6,7)/q+2;;/p-2
InChIKey CKZMBBNCOVDJAY-UHFFFAOYSA-L
Mol Weight 486.32 g/mol
Molecular Formula C11H18F6O6P2S2
Exact Mass 485.992424 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID IKHjPI83e84
Name 1,5-DIPHOSPHONIATRICYCLO-[3.3.3.0]-UNDECANE-BIS-(TRIFLUOROMETHANESULFONATE)
Compound Number 8A
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C11H18F6O6P2S2
InChI InChI=1S/C9H18P2.2CHF3O3S/c1-4-10-6-2-7-11(10,5-1)9-3-8-10;2*2-1(3,4)8(5,6)7/h1-9H2;2*(H,5,6,7)/q+2;;/p-2
InChIKey CKZMBBNCOVDJAY-UHFFFAOYSA-L
Literature Reference Author R.W.ALDER,D.D.ELLIS,R.GLEITER,C.J.HARRIS,H.LANGE,A.G.ORPEN,D .READ,P.N.TAYLOR
Literature Reference Citation J.CHEM.SOC.PERKIN-1,1657(1998)
Literature Reference DOI 10.1039/a800595h
Molecular Weight 486.318 g/mol
Solvent CD3NO2
Source File Reference UWBS1004