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96-99-1

4-Chloro-3-nitrobenzoic acid

Product Name 4-Chloro-3-nitrobenzoic acid

CAS96-99-1

MFC7H4ClNO4

MW201.56

More

  • 96-99-1_ms
    Mass

    MS-NW-1616          
    4-chloro-3-nitrobenzoic acid
    C7H4ClNO4           (Mass of molecular ion:    201)
    

       Source Temperature: 200 °C
       Sample Temperature: 140 °C
       Direct, 75 eV
    

          17.0       1.7
          18.0       7.3
          27.0       1.4
          28.0       2.0
          29.0       1.4
          30.0      60.2
          36.0       1.5
          37.0       6.4
          38.0       5.1
          39.0       6.1
          44.0       2.4
          45.0       7.5
          46.0       1.4
          49.0       3.4
          50.0      16.5
          51.0      11.6
          52.0       1.4
          53.0       5.1
          55.0       1.4
          60.0       1.1
          61.0       4.1
          62.0       4.7
          63.0      17.3
          64.0       3.1
          72.0       1.4
          73.0      24.1
          74.0      29.6
          75.0      42.9
          76.0       4.7
          79.0       1.1
          84.0       6.5
          85.0       3.7
          86.0       2.5
          87.0       3.9
          89.0       1.3
          90.0       1.3
          91.0       2.8
          92.0       2.1
          98.0       1.5
          99.0      86.8
         100.0       5.2
         101.0      28.0
         102.0       2.2
         103.0       1.7
         107.0       2.0
         108.0       1.7
         109.0       9.2
         110.0      13.8
         111.0       5.5
         112.0       4.5
         113.0       1.0
         115.0      28.2
         116.0       1.6
         117.0       9.2
         126.0       4.3
         127.0       3.1
         128.0       1.6
         129.0       1.0
         137.0       2.7
         138.0       8.6
         139.0       4.2
         140.0       2.9
         141.0       1.0
         143.0       8.7
         145.0       3.0
         154.0       1.5
         155.0      14.9
         156.0       4.0
         157.0       5.4
         158.0       1.2
         171.0      34.3
         172.0       2.9
         173.0      11.5
         184.0       5.4
         185.0       3.7
         186.0       2.2
         187.0       1.3
         201.0     100.0
         202.0       8.2
         203.0      33.6
         204.0       2.8
    

400 MHz in DMSO-d6

  • 96-99-1_1hnmr

    1H NMR 399.65 MHz
    C7 H4 Cl N O4 0.038 g : 0.5 ml DMSO-d6
    4-chloro-3-nitrobenzoic acid
    ChemicalStructure
        Assign.     Shift(ppm)
    A 12.4 B 8.496 C 8.189 D 7.914

         Hz     ppm     Int.
    

       3396.48   8.499    934
       3394.53   8.494    975
       3278.32   8.203    485
       3276.37   8.199    445
       3270.02   8.183    537
       3267.82   8.177    549
       3166.99   7.925   1000
       3162.84   7.915     37
       3158.69   7.904    858
       3154.79   7.894     28
    

KBr disc

  • 96-99-1_ir1_2

nujol mull

  • 96-99-1_ir2

4880 A,200 M,powder

  • 96-99-1_raman