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1-BENZYL-5-PHENYL-1,5-DIPHOSPHONIABICYCLO-[3.3.3]-UNDECANE_BIS-(TRIFLUOROMETHANESULFONATE)

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1-BENZYL-5-PHENYL-1,5-DIPHOSPHONIABICYCLO-[3.3.3]-UNDECANE_BIS-(TRIFLUOROMETHANESULFONATE)
SpectraBase Compound ID Kr5bIVZYZTF
InChI InChI=1S/C22H30P2.2CHF3O3S/c1-3-10-21(11-4-1)20-23-14-7-17-24(18-8-15-23,19-9-16-23)22-12-5-2-6-13-22;2*2-1(3,4)8(5,6)7/h1-6,10-13H,7-9,14-20H2;2*(H,5,6,7)/q+2;;/p-2
InChIKey RHIQJJDGBQQAAD-UHFFFAOYSA-L
Mol Weight 654.56 g/mol
Molecular Formula C24H30F6O6P2S2
Exact Mass 654.086324 g/mol

31P Nuclear Magnetic Resonance (NMR) Chemical Shifts

31P Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID G3OF8XiZBLH
Name 1-BENZYL-5-PHENYL-1,5-DIPHOSPHONIABICYCLO-[3.3.3]-UNDECANE_BIS-(TRIFLUOROMETHANESULFONATE)
Compound Number 23C
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C24H30F6O6P2S2
InChI InChI=1S/C22H30P2.2CHF3O3S/c1-3-10-21(11-4-1)20-23-14-7-17-24(18-8-15-23,19-9-16-23)22-12-5-2-6-13-22;2*2-1(3,4)8(5,6)7/h1-6,10-13H,7-9,14-20H2;2*(H,5,6,7)/q+2;;/p-2
InChIKey RHIQJJDGBQQAAD-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
Solvent CD3CN
Source File Reference UWBS1018