ChemicalBook
English   Japanese   Germany   Korea

103-85-5

苯基硫脲(103-85-5)质谱(MS)

产品名称:苯基硫脲

CAS:103-85-5

分子式:C7H8N2S

分子量: 152.22

InChI:InChI=1S/C7H8N2S/c8-7(10)9-6-4-2-1-3-5-6/h1-5H,(H3,8,9,10)

InChIKey: FULZLIGZKMKICU-UHFFFAOYSA-N

Smiles:N(C1=CC=CC=C1)C(N)=S

  • 图谱
    Mass

    MS-NW-0192          
    1-phenylthiourea
    C7H8N2S             (Mass of molecular ion:    152)
    

       Source Temperature: 210 °C
       Sample Temperature:   0 °C
       Direct, 75 eV
    

          26.0       1.3
          27.0       3.2
          28.0       9.3
          32.0       2.3
          33.0       1.4
          37.0       2.9
          38.0       7.2
          39.0      22.0
          40.0       3.9
          41.0       2.9
          42.0       1.3
          43.0       7.3
          45.0       1.4
          50.0       9.1
          51.0      20.6
          52.0       5.2
          53.0       1.3
          54.0       2.2
          59.0       3.0
          60.0      25.2
          61.0       2.0
          62.0       3.0
          63.0       8.0
          64.0       5.3
          65.0      24.7
          66.0      29.5
          67.0       3.5
          69.0       1.3
          73.0       1.3
          74.0       3.1
          75.0       3.0
          76.0       4.0
          77.0      25.1
          78.0       3.9
          80.0       1.5
          90.0       1.1
          91.0       4.4
          92.0      12.3
          93.0     100.0
          94.0       7.2
          97.0       1.0
         104.0       2.2
         109.0       5.2
         110.0      21.7
         111.0       1.8
         112.0       1.1
         118.0       3.8
         119.0      17.2
         120.0       1.8
         124.0       2.2
         135.0       2.4
         136.0       1.1
         151.0       6.4
         152.0      61.9
         153.0       6.2
         154.0       3.1
    

400 MHz in DMSO-d6

  • 图谱

    1H NMR 399.65 MHz
    C7 H8 N2 S 0.040 g : 0.5 ml DMSO-d6
    1-phenylthiourea
    ChemicalStructure
        Assign.     Shift(ppm)
    A 9.70 B 7.402 C 7.329 D 7.122

         Hz     ppm     Int.
    

       3878.33   9.705    580
       2962.95   7.414    580
       2955.32   7.395    896
       2936.25   7.348    823
       2934.11   7.342    274
       2928.77   7.329   1000
       2922.21   7.312    263
       2920.38   7.308    558
       2854.16   7.142    214
       2852.94   7.139    348
       2851.72   7.136    214
       2845.61   7.121    549
       2838.29   7.102    249
    

KBr disc

  • 图谱

nujol mull

  • 图谱

×