3,3'-IMINODIPROPIONITRILE(111-94-4) IR1

Product Name3,3'-IMINODIPROPIONITRILE

CAS 111-94-4

Molecular FormulaC6H9N3

Molecular Weight123.16

InChIInChI=1S/C6H9N3/c7-3-1-5-9-6-2-4-8/h9H,1-2,5-6H2

InChIKey SBAJRGRUGUQKAF-UHFFFAOYSA-N

SmilesN(CCC#N)CCC#N

Request For Quotation

Mass

MS-NW-1305          
3,3'-iminodipropionitrile
C6H9N3              (Mass of molecular ion:    123)

   Source Temperature: 260 °C
   Sample Temperature: 180 °C
   Reservoir, 75 eV

      15.0       3.6
      18.0       1.5
      26.0       7.5
      27.0       8.8
      28.0      23.6
      29.0       3.8
      30.0      23.4
      38.0       1.2
      39.0       1.9
      40.0       5.1
      41.0       6.9
      42.0      95.7
      43.0      11.6
      51.0       3.0
      52.0       8.1
      53.0       6.2
      54.0      52.2
      55.0       4.7
      56.0       4.8
      57.0       1.0
      66.0       1.1
      67.0       1.4
      81.0       6.1
      82.0       3.0
      83.0     100.0
      84.0       5.3

90 MHz in CDCl3

¹H NMR	89.56 MHz
C₆ H₉ N₃	0.04 ml : 0.5 ml CDCl₃
3,3'-iminodipropionitrile

    Assign.     Shift(ppm)

      A             2.96
      B             2.54
      C             1.54

     Hz     ppm     Int.

    273.13   3.050    238
    272.00   3.038    258
    270.06   3.016     37
    265.56   2.966    890
    259.94   2.903    502
    259.31   2.896    531
    233.38   2.606    512
    232.63   2.598    554
    229.69   2.565     38
    228.44   2.551     42
    227.13   2.537   1000
    226.44   2.529    448
    225.69   2.520    377
    222.19   2.481     42
    220.69   2.465    276
    219.50   2.451    271
    137.81   1.539    100

in CDCl3