2-Nitrophenylacetonitrile(610-66-2) Raman

Product Name2-Nitrophenylacetonitrile

CAS 610-66-2

Molecular FormulaC8H6N2O2

Molecular Weight162.15

InChIInChI=1S/C8H6N2O2/c9-6-5-7-3-1-2-4-8(7)10(11)12/h1-4H,5H2

InChIKey YPRFCQAWSNWRLM-UHFFFAOYSA-N

SmilesC1(CC#N)=CC=CC=C1[N+]([O-])=O

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Mass

MS-NW-8747          
(o-nitrophenyl)acetonitrile
C8H6N2O2            (Mass of molecular ion:    162)

   Source Temperature: 160 °C
   Sample Temperature: 110 °C
   Direct, 75 eV

      18.0       4.9
      27.0       2.5
      28.0       4.9
      30.0       5.1
      37.0       3.2
      38.0       6.5
      39.0      23.8
      40.0       2.1
      41.0       3.3
      49.0       1.1
      50.0      15.0
      51.0      14.5
      52.0       9.3
      53.0       1.0
      54.0       2.7
      58.0       1.1
      61.0       4.4
      62.0      13.5
      63.0      36.4
      64.0      17.9
      65.0      13.8
      66.0       2.4
      74.0       5.5
      75.0       6.5
      76.0       8.4
      77.0      26.0
      78.0       6.9
      79.0      31.7
      80.0       2.3
      86.0       1.9
      87.0       4.6
      88.0      15.3
      89.0     100.0
      90.0      37.5
      91.0      36.9
      92.0      23.5
      93.0       3.2
     102.0       1.6
     103.0       1.6
     104.0       7.0
     105.0       7.6
     106.0       1.4
     107.0       1.7
     114.0      12.3
     115.0      21.7
     116.0      43.1
     117.0      23.5
     118.0      11.8
     119.0       5.0
     120.0       3.3
     132.0       1.8
     135.0      97.5
     136.0       8.0
     145.0      11.9
     146.0       1.6
     162.0       9.4
     163.0       1.6