88-42-6

2,5-二氯苯磺酸(88-42-6)红外图谱(IR2)

产品名称:2,5-二氯苯磺酸

CAS:88-42-6

分子式:C6H4Cl2O3S

分子量: 227.07

InChI:InChI=1S/C6H4Cl2O3S/c7-4-1-2-5(8)6(3-4)12(9,10)11/h1-3H,(H,9,10,11)

InChIKey: LFXZSGVZSSMCMB-UHFFFAOYSA-N

Smiles:C1(S(O)(=O)=O)=CC(Cl)=CC=C1Cl

IR1

IR2

Mass

MS-NW-2632          
2,5-dichlorobenzenesulfonic acid
C6H4Cl2O3S 2H2O     (Mass of molecular ion:    226)

   Source Temperature: 240 °C
   Sample Temperature: 140 °C
   Direct, 75 eV

      18.0       3.6
      28.0       2.9
      35.0       1.0
      36.0       6.5
      37.0       3.8
      38.0       2.6
      39.0       1.5
      48.0       2.4
      49.0       2.4
      50.0      11.5
      51.0       3.0
      53.0       1.2
      54.5       1.2
      55.0       1.0
      60.0       1.0
      61.0       2.9
      62.0       3.3
      63.0      23.1
      64.0       1.7
      65.0      20.0
      67.0       1.0
      69.0       1.5
      72.0       1.5
      73.0      11.2
      74.0      32.9
      75.0      30.9
      76.0       2.3
      81.0       1.7
      83.0       1.8
      84.0       8.9
      85.0       6.9
      86.0       3.3
      87.0       2.4
      91.0       1.4
      97.0       1.7
      98.0      23.0
      99.0      18.3
     100.0       8.4
     101.0       5.8
     107.0       1.2
     108.0       1.9
     109.0      54.8
     110.0      13.8
     111.0      20.6
     112.0       4.5
     113.0       1.3
     115.0       1.1
     119.0       1.4
     126.0       9.3
     127.0       2.6
     128.0       4.9
     129.0       1.1
     133.0      21.9
     134.0       4.0
     135.0      14.9
     136.0       2.6
     137.0       2.4
     143.0       2.0
     144.0       5.0
     145.0      48.1
     146.0       7.4
     147.0      29.8
     148.0       3.3
     149.0       5.0
     161.0       2.8
     162.0      84.0
     163.0       7.3
     164.0      55.2
     165.0       4.3
     166.0       9.1
     192.0       2.1
     209.0       3.0
     211.0       2.0
     226.0     100.0
     227.0       7.4
     228.0      64.9
     229.0       4.7
     230.0      12.5

KBr disc