19499-93-5

2,3-Dimethyl-4-nitrophenol(19499-93-5) IR1

Product Name2,3-Dimethyl-4-nitrophenol

CAS 19499-93-5

Molecular FormulaC8H9NO3

Molecular Weight167.16

InChIInChI=1S/C8H9NO3/c1-5-6(2)8(10)4-3-7(5)9(11)12/h3-4,10H,1-2H3

InChIKey DAEZHJNJHQAEPE-UHFFFAOYSA-N

SmilesC1(O)=CC=C([N+]([O-])=O)C(C)=C1C

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2,3-Dimethyl-4-nitrophenol(19499-93-5) IR1
Mass

MS-KW-0721          
2,3-dimethyl-4-nitrophenol 
C8H9NO3             (Mass of molecular ion:    167)

   Source Temperature: 260 °C
   Sample Temperature: 150 °C
   Reservoir, 75 eV

      18.0       4.0
      26.0       1.3
      27.0       9.6
      28.0       6.9
      29.0       2.3
      30.0       2.9
      38.0       3.3
      39.0      19.5
      40.0       3.5
      41.0      12.6
      42.0       2.2
      43.0      10.5
      50.0       5.4
      51.0      14.5
      52.0       7.0
      53.0      17.9
      54.0       4.1
      55.0      13.6
      61.0       1.2
      62.0       2.9
      63.0       7.9
      64.0       2.6
      65.0      20.8
      66.0       7.3
      67.0      20.2
      68.0       2.9
      69.0       3.4
      74.0       1.9
      75.0       2.4
      76.0       1.9
      77.0      57.0
      78.0      10.5
      79.0       9.2
      80.0       8.1
      81.0       6.5
      82.0       2.6
      89.0       2.4
      90.0       1.4
      91.0      39.4
      92.0       8.8
      93.0       7.1
      94.0      19.9
      95.0      17.5
      96.0       2.5
     102.0       1.7
     103.0       5.5
     104.0      13.6
     105.0       4.5
     106.0       4.3
     107.0       4.4
     108.0       2.5
     109.0       1.8
     119.0       4.5
     120.0       8.5
     121.0       7.8
     122.0      14.9
     123.0       6.5
     132.0       1.3
     133.0       4.3
     135.0       1.5
     137.0       3.0
     150.0     100.0
     151.0      10.5
     152.0       1.1
     167.0      71.7
     168.0       7.5

in DMSO-d6