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METHYL 3-AMINOBENZOATE

Product Name METHYL 3-AMINOBENZOATE

CAS4518-10-9

MFC8H9NO2

MW151.16

¹³CNMR

Mass

MS-IW-8788          
methyl m-aminobenzoate
C8H9NO2             (Mass of molecular ion:    151)

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

      28.0       1.5
      38.0       1.7
      39.0       6.4
      41.0       1.9
      45.5       1.0
      46.0       3.3
      52.0       2.4
      60.0       3.8
      62.0       1.4
      63.0       4.4
      64.0       4.0
      65.0      24.4
      66.0       3.6
      90.0       1.6
      91.0       4.4
      92.0      66.8
      93.0      16.1
      94.0       1.1
     106.0       1.5
     119.0       1.2
     120.0      90.4
     121.0       9.0
     150.0       1.1
     151.0     100.0
     152.0       9.4

90 MHz in CDCl3

400 MHz in CDCl3

¹H NMR	89.56 MHz
C₈ H₉ N O₂	0.043 g : 0.5 ml CDCl₃
methyl m-aminobenzoate

    Assign.     Shift(ppm)

      A             7.39
      B             7.34
      C             7.198
      D             6.841
      E             3.872
      F             3.72
     
     J(A,C)=7.5HZ
     J(A,D)=1.3HZ
     J(B,C)=0.6HZ
     J(B,D)=2.4HZ
     J(C,D)=7.8HZ

     Hz     ppm     Int.

    668.19   7.461     37
    666.69   7.445     30
    662.13   7.394     31
    660.56   7.376     91
    659.19   7.361    120
    658.19   7.350     57
    657.31   7.340     72
    656.63   7.332     73
    655.75   7.322     50
    651.69   7.277     53
    651.00   7.269     47
    643.94   7.191     80
    643.31   7.184     66
    636.44   7.107     40
    635.81   7.100     35
    617.50   6.895     44
    616.25   6.881     48
    615.13   6.869     44
    613.75   6.853     41
    346.81   3.873   1000
    332.94   3.718    106

¹H NMR	399.65 MHz
C₈H₉NO₂	0.040 g : 0.5 ml CDCl₃
methyl m-aminobenzoate

    Assign.     Shift(ppm)

     A           7.411
     B           7.345
     C           7.196
     D           6.841
     E           3.876
     F           3.8

     Hz     ppm     Int.

   2968.14   7.425     55
   2967.05   7.422     65
   2966.56   7.421     67
   2965.58   7.418     59
   2960.45   7.406     65
   2959.36   7.403     75
   2958.87   7.402     81
   2957.89   7.399     69
   2938.24   7.350     79
   2937.87   7.349     82
   2936.65   7.346     82
   2936.16   7.345     89
   2935.80   7.344     94
   2935.31   7.343     88
   2934.09   7.340     74
   2933.72   7.339     69
   2884.53   7.216     75
   2884.04   7.215     74
   2876.47   7.196    137
   2868.78   7.176     71
   2868.41   7.175     70
   2740.24   6.855     65
   2739.26   6.852     67
   2737.80   6.849     64
   2736.70   6.846     62
   2732.30   6.835     58
   2731.21   6.832     58
   2729.74   6.829     56
   2728.76   6.826     55
   1552.37   3.884     40
   1549.08   3.875   1000
   1500.98   3.755     15
   1474.49   3.689     14

in CDCl3

KBr disc

nujol mull

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