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570-24-1

2-甲基-6-硝基苯胺(570-24-1)红外图谱(IR2)

分子式:C7H8N2O2

分子量: 152.15

InChI:InChI=1S/C7H8N2O2/c1-5-3-2-4-6(7(5)8)9(10)11/h2-4H,8H2,1H3

InChIKey: FCMRHMPITHLLLA-UHFFFAOYSA-N

Smiles:C1(N)=C([N+]([O-])=O)C=CC=C1C

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    Mass

    MS-NW-6711          
    6-nitro-o-toluidine
    C7H8N2O2            (Mass of molecular ion:    152)
    

       Source Temperature: 260 °C
       Sample Temperature: 190 °C
       Reservoir, 75 eV
    

          18.0       1.7
          27.0       4.3
          28.0       7.3
          30.0       2.7
          37.0       1.6
          38.0       3.0
          39.0      10.6
          40.0       1.3
          41.0       2.8
          42.0       2.1
          44.0       1.1
          50.0       5.0
          51.0      12.1
          52.0      10.9
          53.0       7.8
          54.0       3.3
          62.0       1.6
          63.0       4.4
          64.0       2.6
          65.0       5.8
          66.0       4.5
          67.0       2.3
          74.0       1.3
          75.0       1.6
          76.0       3.2
          77.0      43.4
          78.0      12.6
          79.0      37.0
          80.0       5.0
          89.0       1.8
          90.0       2.4
          91.0       5.7
          92.0       1.2
          93.0       2.2
          94.0       9.5
         103.0       2.1
         104.0      15.9
         105.0      14.4
         106.0      40.9
         107.0       4.1
         116.0       5.9
         117.0       5.5
         118.0       1.1
         122.0       4.3
         134.0       3.4
         135.0       9.1
         136.0       2.3
         151.0       1.0
         152.0     100.0
         153.0       8.5
    

90 MHz in CDCl3

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    1H NMR 89.56 MHz
    C7 H8 N2 O2 0.043 g : 0.5 ml CDCl3
    6-nitro-o-toluidine
    ChemicalStructure
        Assign.     Shift(ppm)
    A 8.007 B 7.268 C 6.620 D 6.14 E 2.235

         Hz     ppm     Int.
    

        722.69   8.070     89
        722.13   8.064     93
        721.13   8.052     99
        720.56   8.046     87
        714.00   7.973    101
        713.50   7.967    104
        712.44   7.955    112
        711.88   7.949     97
        655.94   7.325     84
        655.13   7.315    100
        654.31   7.306    105
        653.50   7.297     79
        649.63   7.254     45
        648.81   7.245    108
        648.00   7.236    133
        647.19   7.227    126
        646.38   7.218     93
        600.19   6.702    154
        593.06   6.622    124
        591.50   6.605    141
        584.38   6.526    108
        200.13   2.235   1000
    

in CDCl3

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KBr disc

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nujol mull

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