99-60-5

2-氯-4-硝基苯甲酸(99-60-5)红外图谱(IR3)

产品名称:2-氯-4-硝基苯甲酸

CAS:99-60-5

分子式:C7H4ClNO4

分子量: 201.56

InChI:InChI=1S/C7H4ClNO4/c8-6-3-4(9(12)13)1-2-5(6)7(10)11/h1-3H,(H,10,11)

InChIKey: QAYNSPOKTRVZRC-UHFFFAOYSA-N

Smiles:C(O)(=O)C1=CC=C([N+]([O-])=O)C=C1Cl

Mass

MS-NW-4777          
2-chloro-4-nitrobenzoic acid
C7H4ClNO4           (Mass of molecular ion:    201)

   Source Temperature: 150 °C
   Sample Temperature: 110 °C
   Direct, 75 eV

      18.0       2.6
      28.0       4.0
      30.0      22.5
      36.0       1.2
      37.0       4.2
      38.0       3.2
      39.0       3.6
      45.0       4.9
      46.0       1.1
      49.0       1.9
      50.0      10.0
      51.0       7.7
      53.0       6.1
      61.0       2.6
      62.0       3.3
      63.0      14.8
      64.0       4.2
      65.0       2.1
      73.0      12.2
      74.0      22.3
      75.0      35.2
      76.0       4.3
      79.0       2.0
      84.0       3.8
      85.0       2.9
      86.0       1.5
      87.0       3.3
      89.0       1.0
      91.0      17.1
      92.0       5.3
      99.0      52.3
     100.0       3.3
     101.0      17.2
     102.0       1.1
     107.0       4.4
     108.0       1.2
     109.0       6.5
     110.0       7.8
     111.0       3.4
     112.0       2.6
     115.0       6.5
     117.0       2.1
     119.0       5.2
     120.0       1.3
     121.0       1.2
     126.0       3.9
     128.0       1.3
     137.0       5.1
     138.0       6.6
     139.0       2.3
     140.0       2.1
     143.0      15.3
     144.0       1.2
     145.0       5.3
     154.0       1.0
     155.0      33.3
     156.0       3.0
     157.0      11.4
     158.0       1.0
     167.0       2.2
     171.0       1.5
     173.0       1.3
     184.0       6.5
     185.0       1.4
     186.0       2.2
     201.0     100.0
     202.0       8.6
     203.0      33.1
     204.0       2.8
     235.0       1.4