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61-78-9

4-Aminohippuric acid

Product Name 4-Aminohippuric acid

CAS61-78-9

MFC9H10N2O3

MW194.19

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  • 61-78-9_ms
    Mass 

    MS-NW-8140          
p-aminohippuric acid
C9H10N2O3           (Mass of molecular ion:    194)


       Source Temperature: 200 °C
   Sample Temperature: 180 °C
   Direct, 75 eV


          18.0       3.1
      28.0       2.2
      38.0       1.1
      39.0       5.1
      41.0       1.8
      44.0       1.0
      52.0       1.4
      63.0       2.5
      64.0       2.7
      65.0      18.1
      66.0       2.5
      91.0       2.8
      92.0      23.8
      93.0       2.5
     118.0       1.0
     119.0       2.5
     120.0     100.0
     121.0       8.4
     149.0       6.0
     150.0      18.6
     151.0       1.8
     176.0       1.4
     194.0      20.7
     195.0       2.3

400 MHz in DMSO-d6

90 MHz in CDCl3

  • 61-78-9_1hnmr_2

    1H NMR 399.65 MHz
    C9 H10 N2 O3 0.040 : 0.5 ml DMSO-d6
    p-aminohippuric acid
    ChemicalStructure 
        Assign.     Shift(ppm)
    
      A             8.36
      B             7.602
      C             6.565
      D             3.872
  

         Hz     ppm     Int.


       3345.22   8.371    172
   3339.45   8.356    348
   3333.47   8.341    170
   3051.19   7.635     25
   3050.55   7.634     25
   3042.86   7.614    949
   3034.10   7.592    973
   2630.45   6.582    159
   2628.10   6.577   1000
   2621.05   6.559    340
   2619.34   6.555    980
   1550.71   3.881    839
   1544.94   3.866    835

  • 61-78-9_1hnmr

    1H NMR 89.56 MHz
    C9 H10 N2 O3 0.046 g : 0.5 ml CDCl3
    p-aminohippuric acid
    ChemicalStructure 
        Assign.     Shift(ppm)
    
      A             8.31
      B             7.597
      C             6.568
      D             3.874
  

         Hz     ppm     Int.


        750.16   8.377    134
    744.18   8.310    281
    738.28   8.244    137
    685.13   7.650    820
    683.42   7.631    268
    676.50   7.554    968
    674.28   7.529    149
    673.94   7.526    150
    594.73   6.641    112
    592.25   6.613   1000
    583.53   6.516    828
    349.91   3.907    703
    344.02   3.842    685

in DMSO-d6

  • 61-78-9_13cnmr

KBr disc

  • 61-78-9_ir1_2

nujol mull

  • 61-78-9_ir2

4880 A,200 M,powder

  • 61-78-9_raman

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