121-86-8

2-Chloro-4-nitrotoluene(121-86-8) ¹³C NMR

Product Name2-Chloro-4-nitrotoluene

CAS 121-86-8

Molecular FormulaC7H6ClNO2

Molecular Weight171.58

InChIInChI=1S/C7H6ClNO2/c1-5-2-3-6(9(10)11)4-7(5)8/h2-4H,1H3

InChIKey LLYXJBROWQDVMI-UHFFFAOYSA-N

SmilesC1(C)=CC=C([N+]([O-])=O)C=C1Cl

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2-Chloro-4-nitrotoluene(121-86-8) <sup>13</sup>C NMR
Mass

MS-NW-1829          
2-chloro-4-nitrotoluene
C7H6ClNO2           (Mass of molecular ion:    171)

   Source Temperature: 250 °C
   Sample Temperature: 180 °C
   Reservoir, 75 eV

      18.0       2.4
      26.0       1.3
      27.0       3.1
      28.0       2.5
      30.0      20.8
      37.0       3.2
      38.0       5.6
      39.0      26.0
      40.0       2.2
      41.0       1.4
      43.0       2.1
      46.0       1.0
      49.0       2.4
      50.0      10.9
      51.0      15.9
      52.0       2.9
      53.0       1.0
      61.0       5.1
      62.0      13.8
      63.0      45.0
      64.0       7.0
      65.0       6.5
      73.0      10.4
      74.0       4.3
      75.0       7.6
      76.0       1.6
      77.0      38.4
      78.0       6.7
      84.0       1.6
      85.0       3.0
      86.0       4.2
      87.0       4.5
      88.0       1.7
      89.0      80.1
      90.0      22.8
      91.0       2.3
      97.0       2.0
      99.0      27.8
     100.0       1.6
     101.0       8.7
     105.0      10.8
     106.0       1.7
     113.0      14.7
     114.0       1.2
     115.0       4.5
     123.0       1.8
     124.0       1.7
     125.0      99.5
     126.0       8.2
     127.0      31.5
     128.0       2.7
     141.0      24.2
     142.0       2.2
     143.0       8.0
     155.0       2.1
     171.0     100.0
     172.0       8.1
     173.0      32.0
     174.0       2.7