5685-05-2

2-Mercaptothiazole(5685-05-2) ¹³C NMR

Product Name2-Mercaptothiazole

CAS 5685-05-2

Molecular FormulaC3H3NS2

Molecular Weight117.19

InChIInChI=1S/C3H3NS2/c5-3-4-1-2-6-3/h1-2H,(H,4,5)

InChIKey OCVLSHAVSIYKLI-UHFFFAOYSA-N

SmilesS1C=CNC1=S

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¹HNMR

¹³CNMR

parameter in acetone-d6

2-Mercaptothiazole(5685-05-2) <sup>13</sup>C NMR

¹H NMR	300 MHz
C₃ H₃ N S₂	in acetone-d₆
2(3H)-thiazolethione

    Parameter     ppm  Hz

      D(A)         7.30
      D(B)         6.95
       J(A,B)          4.6
     
      D(C)         3.32
     
     CHANON,M. & METZGER,J. BULL.SOC.CHIM.FR. 1968, 2868

     Hz     ppm     Int.

   2192.35   7.308    482
   2187.80   7.293    525
   2087.26   6.958    525
   2082.67   6.942    482
    996.01   3.320   1000

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2-Mercaptothiazole(5685-05-2) 13C NMR

2-Mercaptothiazole(5685-05-2) ¹³C NMR