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95-74-9

3-氯对甲苯胺(95-74-9)核磁图(13CNMR)

产品名称:3-氯对甲苯胺

CAS:95-74-9

分子式:C7H8ClN

分子量: 141.6

InChI:InChI=1S/C7H8ClN/c1-5-2-3-6(9)4-7(5)8/h2-4H,9H2,1H3

InChIKey: RQKFYFNZSHWXAW-UHFFFAOYSA-N

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

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    Mass

    MS-NW-5062          
    3-chloro-p-toluidine
    C7H8ClN             (Mass of molecular ion:    141)
    

       Source Temperature: 270 °C
       Sample Temperature: 190 °C
       Reservoir, 75 eV
    

          27.0       2.8
          28.0       4.6
          30.0       1.3
          36.0       2.5
          38.0       1.8
          39.0       3.8
          41.0       1.7
          42.0       1.1
          50.0       4.6
          51.0      10.5
          51.5       2.5
          52.0       7.9
          52.5       8.5
          53.0       3.9
          54.0       2.0
          61.0       1.1
          62.0       1.9
          63.0       3.4
          64.0       1.0
          65.0       1.8
          66.0       1.0
          70.5       2.5
          73.0       1.2
          74.0       1.3
          75.0       1.9
          76.0       2.1
          77.0      21.8
          78.0       8.4
          79.0       6.4
          80.0       1.7
          89.0       1.8
         102.0       1.0
         104.0       9.7
         105.0       5.2
         106.0      65.2
         107.0       6.5
         113.0       2.3
         114.0       1.0
         125.0       1.0
         140.0      82.9
         141.0     100.0
         142.0      33.3
         143.0      32.4
         144.0       2.6
    

90 MHz in CDCl3

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    1H NMR 89.56 MHz
    C7 H8 Cl N 0.04 ml : 0.5 ml CDCl3
    3-chloro-p-toluidine
    ChemicalStructure
        Assign.     Shift(ppm)
    A 6.958 B 6.675 C 6.473 D 3.48 E 2.234

         Hz     ppm     Int.
    

        627.94   7.012    116
        619.88   6.922    163
        599.31   6.692    181
        596.88   6.665    234
        584.13   6.523    149
        581.75   6.496    116
        576.06   6.433    102
        573.69   6.406     85
        311.81   3.482    317
        202.81   2.265     32
        200.50   2.239    998
        200.19   2.236   1000
    

in CDCl3

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liquid film

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