1572-52-7

2-Methyleneglutaronitrile(1572-52-7) ¹H NMR

Product Name2-Methyleneglutaronitrile

CAS 1572-52-7

Molecular FormulaC6H6N2

Molecular Weight106.13

InChIInChI=1S/C6H6N2/c1-6(5-8)3-2-4-7/h1-3H2

InChIKey NGCJVMZXRCLPRQ-UHFFFAOYSA-N

SmilesC(#N)C(=C)CCC#N

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2-Methyleneglutaronitrile(1572-52-7) <sup>1</sup>H NMR
Mass

MS-NW-1035          
2-methyleneglutaronitrile
C6H6N2              (Mass of molecular ion:    106)

   Source Temperature: 240 °C
   Sample Temperature: 130 °C
   Reservoir, 75 eV

      15.0       1.2
      26.0       3.9
      27.0       5.1
      28.0       3.1
      37.0       2.8
      38.0       3.1
      39.0      24.9
      40.0       6.2
      41.0       1.9
      50.0       2.0
      51.0       5.4
      52.0      10.0
      53.0       3.9
      54.0       5.6
      64.0       3.7
      66.0     100.0
      67.0       5.1
      78.0       2.1
      79.0       4.0
     106.0      21.3
     107.0       1.5

90 MHz in CDCl3

2-Methyleneglutaronitrile(1572-52-7) <sup>1</sup>H NMR

¹H NMR	89.56 MHz
C₆ H₆ N₂	0.04 ml : 0.5 ml CDCl₃
2-methyleneglutaronitrile

    Assign.     Shift(ppm)

      A     *1      6.061
      B     *1      5.952
      C          2.66 to 2.60

     Hz     ppm     Int.

    542.88   6.062    454
    534.38   5.967    116
    533.06   5.952    353
    237.31   2.650    468
    236.38   2.640   1000
    236.06   2.636    962
    234.00   2.613    169

in CDCl3