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WebSite > CAS DataBase List >  3898-08-6More Spectrum > 1,1-DIPHENYL-2-THIOUREA(3898-08-6)13CNMR

3898-08-6

1,1-DIPHENYL-2-THIOUREA

Product Name 1,1-DIPHENYL-2-THIOUREA

CAS3898-08-6

MFC13H12N2S

MW228.31

More

  • 3898-08-6_ms_1
    Mass

    MS-NW-0300          
    1,1-diphenylthiourea
    C13H12N2S           (Mass of molecular ion:    228)
    

       Source Temperature: 170 °C
       Sample Temperature:   0 °C
       Direct, 75 eV
    

          16.0       3.0
          17.0       4.3
          27.0       1.1
          32.0       1.5
          35.0       1.7
          36.0      13.4
          38.0       4.5
          39.0       4.4
          50.0       2.9
          51.0      14.3
          52.0       1.6
          59.0       4.4
          60.0       5.6
          63.0       2.3
          64.0       1.9
          65.0       5.5
          66.0       8.6
          74.0       1.0
          75.0       1.0
          76.0       1.5
          77.0      23.6
          78.0       2.5
          83.5       4.5
          84.0       1.0
          84.5       1.0
          91.0       3.3
          92.0       1.5
          93.0       1.4
         104.0       2.6
         109.0       1.1
         110.0       4.5
         114.0       2.7
         115.0       2.9
         118.0      10.1
         119.0     100.0
         120.0       8.8
         126.0       1.0
         128.0       1.0
         139.0       2.1
         140.0       1.7
         141.0       2.8
         142.0       1.7
         143.0       1.0
         154.0       1.3
         166.0       4.5
         167.0      24.5
         168.0      40.4
         169.0      64.3
         170.0       8.4
         193.0       3.1
         194.0      18.9
         195.0       5.9
         196.0       1.1
         227.0       5.5
         228.0      40.3
         229.0       6.6
         230.0       2.2
    

400 MHz in DMSO-d6

90 MHz in DMSO-d6

  • 3898-08-6_1hnmr_2

    1H NMR 399.65 MHz
    C13 H12 N2 S 0.039 g : 0.5 ml DMSO-d6
    1,1-diphenylthiourea
    ChemicalStructure
        Assign.     Shift(ppm)
    A 7.37 B 7.25

         Hz     ppm     Int.
    

       2957.76   7.401     64
       2949.34   7.380    373
       2946.04   7.372    421
       2943.48   7.366   1000
       2939.70   7.356     77
       2938.72   7.354     73
       2937.38   7.350     94
       2907.35   7.275     66
       2904.79   7.269     90
       2901.49   7.261    103
       2898.80   7.254    102
       2896.97   7.249     67
       2895.87   7.247     80
       2892.70   7.239     65
    

  • 3898-08-6_1hnmr_0

    1H NMR 89.56 MHz
    C13 H12 N2 S 0.043 g : 0.5 ml DMSO-d6
    1,1-diphenylthiourea
    ChemicalStructure
        Assign.     Shift(ppm)
    A 7.49 B 7.62 to 7.11

         Hz     ppm     Int.
    

        671.63   7.500     42
        670.50   7.487     46
        669.75   7.479     45
        669.06   7.471     45
        668.69   7.467     45
        667.88   7.458     44
        667.13   7.449     43
        666.44   7.442     45
        662.19   7.394    167
        658.19   7.350   1000
        655.69   7.322    187
        653.88   7.302    101
        652.88   7.290    100
        651.00   7.269     67
        649.75   7.255     48
        649.13   7.248     42
        648.00   7.236     33
        646.63   7.221     52
        645.19   7.204     30
    

in DMSO-d6

  • 3898-08-6_13cnmr_0

KBr disc

  • 3898-08-6_ir1_2

nujol mull

  • 3898-08-6_ir2_1