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返回ChemicalBook首頁>CAS數(shù)據(jù)庫列表>13431-36-2更多圖譜> 4-異丙基-3-氨基硫脲(13431-36-2)核磁圖(1HNMR)

13431-36-2

4-異丙基-3-氨基硫脲(13431-36-2)核磁圖(1HNMR)

產(chǎn)品名稱:4-異丙基-3-氨基硫脲

CAS:13431-36-2

分子式:C4H11N3S

分子量: 133.22

InChI:InChI=1S/C4H11N3S/c1-3(2)6-4(8)7-5/h3H,5H2,1-2H3,(H2,6,7,8)

InChIKey: WMFXGKCDSJXKHO-UHFFFAOYSA-N

Smiles:N(C(NC(C)C)=S)N

  • 圖譜
    Mass

    MS-IW-9189          
    4-isopropyl-3-thiosemicarbazide
    C4H11N3S            (Mass of molecular ion:    133)
    

       Source Temperature: 140 °C
       Sample Temperature: 120 °C
       Direct, 75 eV
    

          15.0       2.2
          17.0       3.1
          18.0      11.9
          27.0      14.0
          28.0      11.3
          29.0       1.9
          30.0       2.7
          31.0      11.8
          32.0     100.0
          33.0       1.5
          39.0       7.9
          40.0       2.0
          41.0      29.7
          42.0      17.9
          43.0      76.3
          44.0      12.1
          45.0       3.4
          47.0       1.2
          48.0       1.6
          56.0       1.2
          57.0       8.2
          58.0      59.6
          59.0       7.3
          60.0      42.3
          61.0       1.7
          62.0       2.2
          69.0       1.2
          74.0       2.0
          75.0       4.8
          83.0      10.3
          84.0       1.1
          86.0       1.7
         100.0       1.6
         101.0       3.5
         102.0       2.9
         103.0       1.5
         115.0       6.2
         116.0      12.8
         117.0       2.8
         118.0       2.3
         133.0      73.6
         134.0       6.3
         135.0       3.5
    

400 MHz in CDCl3

  • 圖譜

    1H NMR 399.65 MHz
    C4 H11 N3 S 0.039 g : 0.5 ml CDCl3
    4-isopropyl-3-thiosemicarbazide
    ChemicalStructure
        Assign.     Shift(ppm)
    A 8.21 B 7.29 C 4.501 D 3.90 E 1.250

         Hz     ppm     Int.
    

       3282.71   8.214     61
       2917.36   7.300     25
       2910.28   7.283     25
       1808.96   4.527     30
       1802.49   4.511     42
       1800.42   4.505     35
       1795.78   4.494     35
       1793.82   4.489     41
       1787.23   4.472     29
       1556.88   3.896    170
        502.93   1.259   1000
        496.46   1.243    979
    

in CDCl3

  • 圖譜

KBr disc

  • 圖譜

nujol mull

  • 圖譜

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