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AYCFTAUCKCHDAF-UHFFFAOYSA-N
SpectraBase Compound ID 2z3SALKev9V
InChI InChI=1S/C14H14F8NO9PS/c1-3-29-33(26,30-4-2)10-7-8(23(24)25)5-6-9(10)31-34(27,28)14(21,22)13(19,20)32-12(17,18)11(15)16/h5-7,11H,3-4H2,1-2H3
InChIKey AYCFTAUCKCHDAF-UHFFFAOYSA-N
Mol Weight 555.28 g/mol
Molecular Formula C14H14F8NO9PS
Exact Mass 554.999915 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 34BNemvEYK
Name 2-(Diethoxyphosphonyl)-4-nitrophenyl 1,1,2,2-tetrafluoro-2-(1,1,2,2-tetrafluoroethoxy)-ethanesulfonate
Alternate Name(s) 2-(diethoxyphosphoryl)-4-nitrophenyl 1,1,2,2-tetrafluoro-2-(1,1,2,2-tetrafluoroethoxy)ethane-1-sulfonate
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C14H14F8NO9PS
InChI InChI=1S/C14H14F8NO9PS/c1-3-29-33(26,30-4-2)10-7-8(23(24)25)5-6-9(10)31-34(27,28)14(21,22)13(19,20)32-12(17,18)11(15)16/h5-7,11H,3-4H2,1-2H3
InChIKey AYCFTAUCKCHDAF-UHFFFAOYSA-N
Literature Reference DOI 10.1002/hc.20156
Molecular Weight 555.285 g/mol
SMILES c1(OS(=O)(C(F)(C(F)(F)OC(C(F)F)(F)F)F)=O)c(cc(cc1)[N+](=O)[O-])P(OCC)(=O)OCC
SPLASH splash10-0zfr-1590040000-654e8e2559a86edd31b8
Source of Spectrum HAC-16-532-4d
Wiley ID 1783587