4-Amino-2-chlorobenzoic acid(2457-76-3) ¹H NMR

Product Name4-Amino-2-chlorobenzoic acid

CAS 2457-76-3

Molecular FormulaC7H6ClNO2

Molecular Weight171.58

InChIInChI=1S/C7H6ClNO2/c8-6-3-4(9)1-2-5(6)7(10)11/h1-3H,9H2,(H,10,11)

InChIKey MBDUKNCPOPMRJQ-UHFFFAOYSA-N

SmilesC(O)(=O)C1=CC=C(N)C=C1Cl

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Mass

MS-NW-7340          
4-amino-2-chlorobenzoic acid
C7H6ClNO2           (Mass of molecular ion:    171)

   Source Temperature: 170 °C
   Sample Temperature: 120 °C
   Direct, 75 eV

      17.0       1.1
      18.0       5.2
      28.0       4.1
      32.0       1.1
      37.0       1.7
      38.0       2.3
      39.0       3.1
      41.0       3.9
      44.0       1.0
      44.5       2.0
      45.0       2.3
      45.5       2.3
      50.0       1.7
      51.0       2.1
      52.0       3.8
      53.0       1.4
      53.5       1.2
      61.0       2.8
      62.0       5.2
      63.0      12.3
      64.0       4.5
      65.0       4.7
      66.0       1.1
      71.5       6.6
      72.0       1.2
      72.5       2.5
      73.0       3.4
      74.0       1.4
      75.0       1.4
      77.0       2.7
      78.0       1.7
      79.0       1.9
      80.0       2.2
      89.0       1.9
      90.0      11.2
      91.0       4.9
      92.0       1.8
      99.0      13.3
     100.0       1.5
     101.0       4.7
     120.0       1.8
     125.0       1.3
     126.0      14.5
     127.0       2.3
     128.0       5.1
     137.0       1.8
     142.0       1.6
     143.0       1.3
     154.0     100.0
     155.0       8.6
     156.0      32.7
     157.0       3.0
     171.0      91.0
     172.0       8.4
     173.0      30.1
     174.0       2.8