5-Chloro-1-methyl-4-nitroimidazole(4897-25-0) IR1

Product Name5-Chloro-1-methyl-4-nitroimidazole

CAS 4897-25-0

Molecular FormulaC4H4ClN3O2

Molecular Weight161.55

InChIInChI=1S/C4H4ClN3O2/c1-7-2-6-4(3(7)5)8(9)10/h2H,1H3

InChIKey OSJUNMSWBBOTQU-UHFFFAOYSA-N

SmilesC1N(C)C(Cl)=C([N+]([O-])=O)N=1

Request For Quotation

IR1

IR2

Mass

MS2004-02538WA      
5-chloro-1-methyl-4-nitroimidazole
C4H4ClN3O2          (Mass of molecular ion:    161)

   Source Temperature: 120 °C
   Sample Temperature: 100 °C
   Direct, 70 eV

      14.0       1.0
      15.0      17.8
      17.0       1.3
      18.0       6.6
      26.0       2.8
      27.0       4.3
      28.0      10.2
      29.0       1.6
      30.0      16.1
      36.0       1.3
      38.0       4.7
      39.0       4.4
      40.0       4.6
      41.0       5.0
      42.0      34.0
      43.0       1.5
      44.0       1.4
      46.0       1.5
      47.0       4.6
      48.0       1.2
      49.0      10.4
      50.0       1.0
      51.0       9.0
      52.0       8.7
      53.0       7.8
      59.0       1.0
      61.0       4.6
      62.0       2.1
      63.0       2.4
      64.0       1.0
      65.0       2.0
      66.0       1.1
      67.0       4.2
      73.0       4.8
      74.0      14.3
      75.0       5.8
      76.0      83.0
      77.0       4.2
      78.0      26.0
      79.0       3.8
      80.0      19.7
      81.0       1.2
      83.0      13.4
      86.0       4.4
      87.0       1.2
      88.0       5.6
      89.0       1.1
      90.0       1.7
     100.0       2.5
     102.0       1.0
     104.0      17.6
     106.0       5.6
     110.0       4.2
     115.0      17.4
     117.0       5.6
     131.0       3.8
     133.0       1.3
     145.0       4.2
     147.0       1.4
     161.0     100.0
     162.0       5.8
     163.0      33.0
     164.0       1.9

KBr disk