2,6-BIS(CHLOROMETHYL)PYRIDINE(3099-28-3) IR2

Product Name2,6-BIS(CHLOROMETHYL)PYRIDINE

CAS 3099-28-3

Molecular FormulaC7H7Cl2N

Molecular Weight176.04

InChIInChI=1S/C7H7Cl2N/c8-4-6-2-1-3-7(5-9)10-6/h1-3H,4-5H2

InChIKey IWQNFYRJSVJWQA-UHFFFAOYSA-N

SmilesC1(CCl)=NC(CCl)=CC=C1

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Mass

MS-IW-5458          
2,6-bis(chloromethyl)pyridine
C7H7Cl2N            (Mass of molecular ion:    175)

   Source Temperature: 230 °C
   Sample Temperature: 150 °C
   Reservoir, 75 eV

      26.0       1.2
      27.0       2.2
      28.0       1.7
      36.0       1.3
      37.0       2.1
      38.0       5.9
      39.0      15.4
      40.0       1.5
      41.0       1.9
      49.0       3.8
      50.0       4.1
      51.0       9.8
      51.5       2.7
      52.0       5.5
      53.0       1.4
      61.0       1.9
      62.0       3.5
      63.0      10.9
      64.0       8.2
      65.0       8.4
      66.0       1.2
      69.5       4.7
      70.5       1.5
      73.0       3.3
      75.0       3.0
      76.0       2.4
      77.0      35.1
      78.0       9.7
      79.0       1.3
      90.0      12.9
      91.0       4.1
      99.0       4.4
     100.0       5.7
     101.0       1.7
     102.0       4.2
     103.0       1.6
     104.0      47.7
     105.0      14.0
     106.0       1.0
     112.0       1.7
     113.0       6.0
     114.0       1.8
     115.0       1.9
     126.0       3.2
     128.0       1.0
     139.0      34.7
     140.0      69.1
     141.0      16.7
     142.0      22.3
     143.0       1.8
     175.0     100.0
     176.0       8.7
     177.0      64.9
     178.0       5.4
     179.0      10.7

400 MHz in CDCl3

¹H NMR	399.65 MHz
C₇ H₇ Cl₂ N	0.053 g : 0.5 ml CDCl₃
2,6-bis(chloromethyl)pyridine

    Assign.     Shift(ppm)

      A             7.759
      B             7.434
      C             4.663

     Hz     ppm     Int.

   3109.50   7.781     68
   3101.68   7.761    129
   3093.99   7.742     87
   2974.98   7.444    226
   2967.16   7.425    204
   1863.65   4.664   1000

in CDCl3