Product Name5-Fluoro-3-thienyl methyl ketone

CAS

Molecular FormulaC6H5FOS

Molecular Weight144.1667032

InChIInChI=1S/C6H5FOS/c1-4(8)5-2-6(7)9-3-5/h2-3H,1H3

InChIKey AKJJKTWKLHLGNS-UHFFFAOYSA-N

SmilesC(C1C=C(F)SC=1)(C)=O

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¹HNMR

Raman

    Parameter     ppm  Hz

      D(A)         7.42
      D(B)         6.79
      D(X)        33.40
       J(A,B)          1.88
       J(A,X)          3.55
       J(B,X)          1.53
     
      D(C)         2.33
     
     RODMAR,S. ET AL. ACTA CHEM.SCAND. 25, 3309 (1971)
     F-19 REFERENCE:HEXAFLUOROBENZENE.

Spectral Code: 1H NMR : parameter in cyclohexane

Spectral Code: Raman : 4880 A,200 M,powder

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