Product Name5-Fluoro-2-thienyl methyl sulfone
Molecular FormulaC5H5FO2S2
Molecular Weight180.2204032
InChIInChI=1S/C5H5FO2S2/c1-10(7,8)5-3-2-4(6)9-5/h2-3H,1H3
InChIKey UHCOSKROUFGIHD-UHFFFAOYSA-N
SmilesS(C1SC(F)=CC=1)(C)(=O)=O
Parameter ppm Hz
D(A) 6.80 D(B) 7.50 D(C) 3.23 D(X) 42.65 J(A,B) 4.30 J(A,C) 0.0 J(A,X) 1.47 J(B,C) 0.13 J(B,X) 3.75 J(C,X) 0.32 RODMAR,S. ET AL. ACTA CHEM.SCAND. 25, 3309 (1971) F-19 REFERENCE:HEXAFLUOROBENZENE.
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