631-58-3

硫代丙酰胺(631-58-3)核磁图(¹³CNMR)

产品名称:硫代丙酰胺

CAS:631-58-3

分子式:C3H7NS

分子量: 89.16

InChI:InChI=1S/C3H7NS/c1-2-3(4)5/h2H2,1H3,(H2,4,5)

InChIKey: WPZSAUFQHYFIPG-UHFFFAOYSA-N

Smiles:C(N)(=S)CC

¹HNMR

¹³CNMR

IR1

Mass

MS-NW-2923          
thiopropionamide
C3H7NS              (Mass of molecular ion:     89)

   Source Temperature: 280 °C
   Sample Temperature: 180 °C
   Reservoir, 75 eV

      15.0       2.6
      18.0       1.8
      26.0       5.4
      27.0      10.2
      28.0      37.9
      29.0       7.1
      30.0       7.4
      32.0       3.3
      33.0       3.1
      34.0       6.4
      39.0       2.0
      40.0       1.5
      41.0       1.9
      42.0       4.2
      44.0       2.6
      45.0       6.4
      46.0       1.0
      47.0       1.2
      51.0       2.2
      52.0       3.7
      53.0       1.6
      54.0      17.8
      55.0       3.4
      56.0      28.1
      57.0       1.7
      58.0       1.5
      59.0       4.4
      60.0      68.7
      61.0       8.6
      62.0       3.3
      71.0       7.6
      72.0      10.3
      73.0       2.7
      74.0       1.4
      87.0       1.7
      88.0       5.2
      89.0     100.0
      90.0       4.8
      91.0       4.6

90 MHz in CDCl3

¹H NMR	89.56 MHz
C₃ H₇ N S	0.055 g : 0.5 ml CDCl₃
thiopropionamide

    Assign.     Shift(ppm)

      A             7.6
      B             2.695
      C             1.304

     Hz     ppm     Int.

    672.75   7.512     52
    253.25   2.828    125
    252.63   2.821    126
    250.38   2.796     25
    249.81   2.790     28
    245.25   2.739    441
    242.56   2.709     38
    237.75   2.655    495
    235.00   2.624     35
    233.63   2.609     29
    232.75   2.599     30
    230.75   2.577    171
    230.19   2.571    173
    123.75   1.382    553
    121.13   1.353     58
    120.25   1.343     57
    116.38   1.300   1000
    108.81   1.215    421

in CDCl3