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Back ChemicalBook Home>CAS DataBase List>94-68-8More Spectrum> 2-Ethylaminotoluene(94-68-8) IR2

2-Ethylaminotoluene(94-68-8) IR2

Product Name2-Ethylaminotoluene

CAS94-68-8

Molecular FormulaC9H13N

Molecular Weight135.21

InChIInChI=1S/C9H13N/c1-3-10-9-7-5-4-6-8(9)2/h4-7,10H,3H2,1-2H3

InChIKey MWOUGPLLVVEUMM-UHFFFAOYSA-N

SmilesC1(NCC)=CC=CC=C1C


  • Mass

    MS-NW-0553          
    N-ethyl-o-toluidine
    C9H13N              (Mass of molecular ion:    135)
    

       Source Temperature: 270 °C
       Sample Temperature: 180 °C
       Reservoir, 75 eV
    

          18.0       1.6
          27.0       2.5
          28.0       1.6
          29.0       1.0
          30.0       1.0
          39.0       4.2
          41.0       1.5
          42.0       1.0
          44.0       1.0
          50.0       1.2
          51.0       3.4
          52.0       1.9
          53.0       1.3
          58.5       1.4
          59.5       1.4
          60.0       1.5
          63.0       2.0
          65.0       7.9
          77.0       6.6
          78.0       2.3
          79.0       2.4
          89.0       1.6
          91.0      18.4
          92.0       3.3
          93.0       2.1
         104.0       1.4
         106.0       6.7
         107.0       1.2
         117.0       1.4
         118.0       6.9
         119.0       2.6
         120.0     100.0
         121.0       9.1
         134.0       6.5
         135.0      42.9
         136.0       4.4
    

400 MHz in CDCl3


  • 1H NMR 399.65 MHz
    C9 H13 N 0.05 ml : 0.5 ml CDCl3
    N-ethyl-o-toluidine
    ChemicalStructure
        Assign.     Shift(ppm)
    A 7.104 B 7.020 C 6.632 D 6.582 E 3.28 F 3.144 G 2.092 J 1.256

         Hz     ppm     Int.
    

       2848.14   7.127     57
       2847.66   7.126     58
       2846.56   7.123     65
       2840.21   7.107    119
       2839.60   7.106    118
       2839.11   7.104    121
       2838.62   7.103    123
       2832.76   7.089     66
       2832.28   7.087     66
       2831.05   7.084     74
       2810.18   7.032    117
       2809.33   7.030    114
       2802.86   7.014    128
       2802.00   7.012    123
       2658.33   6.652     91
       2657.10   6.649    101
       2650.88   6.634    163
       2649.78   6.631    177
       2643.55   6.615     78
       2642.46   6.612     85
       2634.77   6.593    163
       2626.71   6.573    150
       1267.46   3.172    150
       1260.38   3.154    429
       1253.30   3.136    424
       1246.09   3.118    152
        836.43   2.093   1000
        509.28   1.275    538
        502.20   1.257    938
        495.00   1.239    489
    

in CDCl3



CCl4 solution



liquid film



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