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1-HYDROXY-1-PHOSPHA-6-PHOSPHONIATRICYCLO[4.4.4.0]TETRADECANE_TRIFLUOROMETHANESULFONATE
SpectraBase Compound ID 84G2hM9qSoH
InChI InChI=1S/C12H25P2.CHF3O3S/c1-2-8-14-11-5-3-9-13(14,7-1)10-4-6-12-14;2-1(3,4)8(5,6)7/h13H,1-12H2;(H,5,6,7)/q+1;/p-1
InChIKey AYQSGVPFLZJUKS-UHFFFAOYSA-M
Mol Weight 380.34 g/mol
Molecular Formula C13H25F3O3P2S
Exact Mass 380.095174 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID QNkxARCxKT
Name 1-HYDROXY-1-PHOSPHA-6-PHOSPHONIATRICYCLO-[4.4.4.0]-TETRADECANE-TRIFLUOROMETHANESULFONATE
Compound Number 15B
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C13H24F3O3P2S
InChI InChI=1S/C12H25P2.CHF3O3S/c1-2-8-14-11-5-3-9-13(14,7-1)10-4-6-12-14;2-1(3,4)8(5,6)7/h13H,1-12H2;(H,5,6,7)/q+1;/p-1
InChIKey AYQSGVPFLZJUKS-UHFFFAOYSA-M
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 379.334 g/mol
Solvent CD2Cl2