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Back ChemicalBook Home>CAS DataBase List>95-80-7More Spectrum> 2,4-Diaminotoluene(95-80-7) 1H NMR

2,4-Diaminotoluene(95-80-7) 1H NMR

Product Name2,4-Diaminotoluene

CAS95-80-7

Molecular FormulaC7H10N2

Molecular Weight122.17

InChIInChI=1S/C7H10N2/c1-5-2-3-6(8)4-7(5)9/h2-4H,8-9H2,1H3

InChIKey VOZKAJLKRJDJLL-UHFFFAOYSA-N

SmilesC1(N)=CC=C(C)C(N)=C1


  • Mass

    MS-NW-3599          
    2,4-toluenediamine
    C7H10N2             (Mass of molecular ion:    122)
    

       Source Temperature: 280 °C
       Sample Temperature: 180 °C
       Reservoir, 75 eV
    

          18.0       2.2
          27.0       2.3
          28.0       4.7
          30.0       1.2
          38.0       1.3
          39.0       4.1
          40.0       2.1
          41.0       4.6
          42.0       3.8
          50.0       2.1
          51.0       4.9
          52.0       4.7
          53.0       3.7
          54.0       3.3
          60.0       1.4
          60.5       1.4
          61.0       4.5
          63.0       1.1
          65.0       3.4
          66.0       3.3
          67.0       4.0
          68.0       1.0
          76.0       1.1
          77.0      10.9
          78.0       6.1
          79.0       1.8
          80.0       4.0
          81.0       1.8
          92.0       1.6
          93.0       5.5
          94.0      18.4
          95.0       3.0
         104.0      11.1
         105.0      13.9
         106.0       7.7
         119.0       1.6
         121.0      96.2
         122.0     100.0
         123.0       8.3
    

90 MHz in CDCl3


  • 1H NMR 89.56 MHz
    C7 H10 N2 0.047 g : 0.5 ml CDCl3
    2,4-toluenediamine
    ChemicalStructure
        Assign.     Shift(ppm)
    A 6.79 B 6.03 C 5.99 D 3.45 E 2.03

         Hz     ppm     Int.
    

        612.81   6.843    101
        612.13   6.835    143
        611.38   6.827     99
        605.31   6.759    116
        604.63   6.752    180
        603.88   6.743    132
        602.38   6.726     24
        546.75   6.105    110
        544.44   6.080    174
        539.00   6.019     31
        536.69   5.993    416
        534.81   5.972    117
        534.50   5.969    117
        308.50   3.445    709
        182.38   2.037    926
        182.00   2.033   1000
    

in CDCl3



KBr disc



nujol mull





2,4-Diaminotoluene(95-80-7) 1H NMR Atlas of Related Products

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