 
                    
Product Name4-Methylthiosemicarbazide
CAS6610-29-3
Molecular FormulaC2H7N3S
Molecular Weight105.16
InChIInChI=1S/C2H7N3S/c1-4-2(6)5-3/h3H2,1H3,(H2,4,5,6)
InChIKey PTVZQOAHCSKAAS-UHFFFAOYSA-N
SmilesN(C(NC)=S)N
                                            
                                            
Mass
MS-NW-4968 4-methyl(thiosemicarbazide) C2H7N3S (Mass of molecular ion: 105)
Source Temperature: 140 °C Sample Temperature: 100 °C Direct, 75 eV
      15.0      10.2
      16.0       1.1
      17.0       3.5
      18.0       3.7
      27.0       1.2
      28.0      12.0
      29.0       3.3
      30.0      14.1
      31.0       7.7
      32.0     100.0
      33.0       1.0
      42.0       9.8
      43.0       3.1
      45.0       3.9
      46.0       1.2
      47.0       7.2
      48.0       1.0
      55.0       4.2
      56.0       1.3
      57.0       6.2
      59.0       4.9
      60.0       6.4
      62.0       1.9
      72.0       1.5
      73.0       1.8
      74.0      38.9
      75.0       3.8
      76.0       2.1
     105.0      64.3
     106.0       3.1
     107.0       3.2
400 MHz in DMSO-d6
                                            
                                            
| 1H NMR | 399.65 MHz | 
| C2 H7 N3 S | 0.041 g : 0.5 ml DMSO-d6 | 
| 4-methyl(thiosemicarbazide) | |
|  | 
| 
    Assign.     Shift(ppm) | 
     Hz     ppm     Int.
3416.87 8.550 243 3121.46 7.811 82 1764.53 4.416 580 1160.89 2.905 977 1156.25 2.894 1000 1149.90 2.878 52
in DMSO-d6
                                            
                                            
                                        
KBr disc
                                            
                                            
                                        
nujol mull
                                            
                                            
                                        
                                            
                                            
                                        
4-Methylthiosemicarbazide(6610-29-3) 1H NMR Atlas of Related Products
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