122-80-5

4'-Aminoacetanilide(122-80-5) ¹³C NMR

Product Name4'-Aminoacetanilide

CAS 122-80-5

Molecular FormulaC8H10N2O

Molecular Weight150.18

InChIInChI=1S/C8H10N2O/c1-6(11)10-8-4-2-7(9)3-5-8/h2-5H,9H2,1H3,(H,10,11)

InChIKey CHMBIJAOCISYEW-UHFFFAOYSA-N

SmilesC(NC1=CC=C(N)C=C1)(=O)C

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4'-Aminoacetanilide(122-80-5) <sup>13</sup>C NMR
Mass

MS-NW-1717          
4'-aminoacetanilide
C8H10N2O            (Mass of molecular ion:    150)

   Source Temperature: 190 °C
   Sample Temperature: 130 °C
   Direct, 75 eV

      15.0       3.0
      18.0       2.0
      27.0       2.0
      28.0       5.1
      39.0       2.8
      41.0       1.8
      42.0       1.4
      43.0      12.1
      51.0       2.1
      52.0       7.5
      53.0      10.6
      54.0       3.8
      55.0       1.0
      63.0       1.8
      64.0       1.1
      65.0       2.3
      67.0       1.2
      78.0       1.6
      79.0       3.2
      80.0      23.7
      81.0       9.0
      90.0       1.1
      91.0       1.5
     105.0       2.0
     106.0       2.5
     107.0      35.2
     108.0     100.0
     109.0       9.1
     134.0       1.0
     150.0      61.8
     151.0       5.9

90 MHz in DMSO-d6

4'-Aminoacetanilide(122-80-5) <sup>13</sup>C NMR

¹H NMR	89.56 MHz
C₈ H₁₀ N₂ O	0.044 g : 0.5 ml DMSO-d₆
4'-aminoacetanilide

    Assign.     Shift(ppm)

      A             9.47
      B             7.20
      C             6.50
      D             4.78
      E             1.960

     Hz     ppm     Int.

    847.94   9.468     78
    649.44   7.252    201
    647.38   7.229     72
    642.69   7.177     76
    640.69   7.154    265
    637.81   7.122     36
    588.94   6.576     33
    586.06   6.544    299
    583.88   6.520     86
    579.31   6.469     75
    577.25   6.446    220
    574.31   6.413     24
    428.06   4.780    207
    175.50   1.960   1000

in DMSO-d6