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Molecular FormulaC5H5FS2

Molecular Weight148.2216032

InChIInChI=1S/C5H5FS2/c1-7-5-3-2-4(6)8-5/h2-3H,1H3

InChIKey QOVOPFXFQWUVQB-UHFFFAOYSA-N

SmilesS(C1SC(F)=CC=1)C



  •     Parameter     ppm  Hz
    D(A) 6.67 D(B) 6.19 D(C) 2.32 D(X) 39.07 J(A,B) 4.02 J(A,C) 0.0 J(A,X) 3.49 J(B,C) 0.06 J(B,X) 2.52 J(C,X) 0.30 RODMAR,S. ET AL. ACTA CHEM.SCAND. 25, 3309 (1971) F-19 REFERENCE:HEXAFLUOROBENZENE.
    Spectral Code: 1H NMR : parameter in cyclohexane

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