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AYCFTAUCKCHDAF-UHFFFAOYSA-N

View entire compound with spectra: 3 NMR, and 1 MS (GC)

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

19F Nuclear Magnetic Resonance (NMR) Chemical Shifts

19F Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID eILPIw1IOF
Name AYCFTAUCKCHDAF-UHFFFAOYSA-N
Compound Number 4D
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. 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 Author A.Y.PENG,Y.X.DING
Literature Reference Citation J.AM.CHEM.SOC.,125,15006(2003)
Literature Reference DOI 10.1021/ja038627f
Solvent CDCl3
Source File Reference UWSI35599