Ammonium 1-pyrrolidinedithiocarbamate(5108-96-3) ¹³C NMR

Product NameAmmonium 1-pyrrolidinedithiocarbamate

CAS 5108-96-3

Molecular FormulaC5H9NS2.H3N

Molecular Weight164.3

InChIInChI=1S/C5H9NS2.H3N/c7-5(8)6-3-1-2-4-6;/h1-4H2,(H,7,8);1H3

InChIKey MDDIUTVUBYEEEM-UHFFFAOYSA-N

SmilesN1(CCCC1)C(=S)S.N

Request For Quotation

Ammonium 1-pyrrolidinedithiocarbamate(5108-96-3) <sup>13</sup>C NMR
Mass

MS-NW-1972          
ammonium 1-pyrrolidinecarbodithioate
C5H12N2S2           (Mass of molecular ion:    164)

   Source Temperature: 160 °C
   Sample Temperature: 100 °C
   Direct, 75 eV

      15.0       3.3
      16.0      11.5
      17.0      18.1
      18.0       3.1
      26.0       2.0
      27.0      12.9
      28.0      20.7
      29.0       7.7
      30.0       6.0
      32.0      10.2
      38.0       2.5
      39.0       9.0
      40.0       2.2
      41.0      15.8
      42.0       8.1
      43.0      31.1
      44.0      12.9
      45.0       5.2
      46.0       1.2
      53.0       2.7
      54.0       3.3
      55.0      51.1
      56.0       3.1
      58.0       2.2
      59.0       2.7
      60.0       5.0
      64.0       2.6
      68.0       4.1
      69.0       1.2
      70.0      29.4
      71.0       9.4
      72.0      77.7
      73.0       3.0
      74.0       3.5
      76.0     100.0
      77.0      10.1
      78.0      10.0
      85.0       3.7
      86.0      17.7
      87.0       1.9
     114.0      66.8
     115.0       7.7
     116.0       3.3
     146.0       2.5
     147.0      80.2
     148.0       6.2
     149.0       7.0

400 MHz in DMSO-d6

Ammonium 1-pyrrolidinedithiocarbamate(5108-96-3) <sup>13</sup>C NMR

¹H NMR	399.65 MHz
C₅ H₁₂ N₂ S₂	0.041 g : 0.5 ml DMSO-d₆
ammonium 1-pyrrolidinecarbodithioate

    Assign.     Shift(ppm)

      A             7.23
      B             3.666
      C             1.844

     Hz     ppm     Int.

   2887.21   7.225    135
   1487.18   3.722     26
   1481.45   3.707     54
   1465.21   3.667    995
   1441.28   3.607     22
    742.80   1.859    493
    736.45   1.843   1000
    714.11   1.787     26
    712.77   1.784     22

in DMSO-d6