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41406-00-2

3-氨基苯异丙醚(41406-00-2)质谱(MS)

产品名称:3-氨基苯异丙醚

CAS:41406-00-2

分子式:C9H13NO

分子量: 151.21

InChI:InChI=1S/C9H13NO/c1-7(2)11-9-5-3-4-8(10)6-9/h3-7H,10H2,1-2H3

InChIKey: QMGBIPKOKCSUCL-UHFFFAOYSA-N

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

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    Mass

    MS-IW-6462          
    m-isopropoxyaniline
    C9H13NO             (Mass of molecular ion:    151)
    

       Source Temperature: 220 °C
       Sample Temperature: 150 °C
       Reservoir, 75 eV
    

          27.0       2.6
          28.0       1.4
          39.0       4.3
          40.0       1.0
          41.0       4.7
          42.0       1.8
          43.0       2.3
          52.0       1.7
          53.0       3.7
          54.0       1.2
          63.0       1.1
          64.0       1.3
          65.0       4.1
          66.0       1.1
          68.0       1.7
          80.0      11.9
          81.0       8.7
          82.0       2.2
          91.0       1.1
          92.0       2.6
         108.0       2.8
         109.0     100.0
         110.0       7.6
         136.0       1.9
         151.0      28.7
         152.0       3.0
    

400 MHz in CDCl3

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    1H NMR 399.65 MHz
    C9 H13 N O 0.05 ml : 0.5 ml CDCl3
    m-isopropoxyaniline
    ChemicalStructure
        Assign.     Shift(ppm)
    A 7.012 B 6.292 C 6.226 D 6.203 E 4.463 F 3.62 G 1.291

         Hz     ppm     Int.
    

       2810.42   7.033     99
       2810.06   7.032     94
       2802.25   7.012    194
       2794.43   6.993    114
       2520.39   6.307     73
       2519.65   6.305     81
       2518.07   6.301     82
       2517.33   6.299     84
       2512.21   6.287     67
       2511.35   6.284     74
       2509.89   6.281     78
       2509.03   6.279     79
       2494.02   6.241     81
       2493.16   6.239     86
       2491.94   6.236    113
       2491.09   6.234    104
       2486.33   6.222     62
       2485.35   6.219     73
       2484.13   6.216    133
       2483.28   6.214    120
       2481.08   6.209    147
       2478.88   6.203    188
       2476.68   6.198     87
       1796.02   4.494     38
       1789.92   4.479     93
       1783.81   4.464    123
       1777.83   4.449     94
       1771.73   4.434     39
       1447.27   3.622     69
        523.44   1.310     55
        519.04   1.299   1000
        512.94   1.284    960
    

in CDCl3

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liquid film

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