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Back ChemicalBook Home>CAS DataBase List>90-04-0More Spectrum> o-Anisidine(90-04-0) IR2

o-Anisidine(90-04-0) IR2

Product Nameo-Anisidine

CAS90-04-0

Molecular FormulaC7H9NO

Molecular Weight123.15

InChIInChI=1S/C7H9NO/c1-9-7-5-3-2-4-6(7)8/h2-5H,8H2,1H3

InChIKey VMPITZXILSNTON-UHFFFAOYSA-N

SmilesC1(N)=CC=CC=C1OC


  • Mass

    MS-NW-0463          
    o-anisidine
    C7H9NO              (Mass of molecular ion:    123)
    

       Source Temperature: 240 °C
       Sample Temperature: 150 °C
       Reservoir, 75 eV
    

          15.0       1.8
          18.0       2.2
          26.0       1.3
          27.0       4.5
          28.0       5.2
          37.0       1.3
          38.0       3.0
          39.0       8.5
          40.0       1.2
          41.0       3.0
          42.0       1.2
          43.0       1.0
          50.0       3.3
          51.0       6.2
          52.0      10.8
          53.0      15.2
          54.0       3.2
          62.0       1.4
          63.0       3.3
          64.0       1.8
          65.0      10.4
          66.0       2.2
          77.0       2.8
          78.0       2.6
          79.0       2.1
          80.0      65.8
          81.0       4.4
          91.0       1.5
          92.0       5.6
          93.0       2.1
          94.0       2.1
         105.0       2.7
         106.0       1.4
         108.0      98.1
         109.0       7.5
         122.0       1.2
         123.0     100.0
         124.0       8.0
    

400 MHz in CDCl3


  • 1H NMR 399.65 MHz
    C7 H9 N O 0.05 ml : 0.5 ml CDCl3
    o-anisidine
    ChemicalStructure
        Assign.     Shift(ppm)
    A 6.76 B 6.74 C 6.700 D 6.653 E 3.769 F 3.7

         Hz     ppm     Int.
    

       2710.69   6.783     66
       2708.86   6.779     76
       2703.49   6.765    153
       2701.78   6.761    185
       2700.20   6.757     90
       2698.36   6.752    115
       2696.41   6.747     97
       2694.58   6.743    210
       2692.02   6.736    242
       2690.55   6.733    131
       2683.59   6.715    161
       2681.76   6.711    188
       2676.51   6.698    114
       2674.93   6.694    105
       2673.71   6.691     84
       2668.46   6.677     55
       2666.75   6.673     58
       2662.84   6.663    206
       2661.01   6.659    145
       2655.40   6.645    146
       2653.81   6.641    114
       1506.47   3.770   1000
       1497.19   3.747     48
    

in CDCl3



CCl4 solution



liquid film





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