2,3-Dichloro-5-(trifluoromethyl)pyridine(69045-84-7) Raman

Product Name2,3-Dichloro-5-(trifluoromethyl)pyridine

CAS 69045-84-7

Molecular FormulaC6H2Cl2F3N

Molecular Weight215.99

InChIInChI=1S/C6H2Cl2F3N/c7-4-1-3(6(9,10)11)2-12-5(4)8/h1-2H

InChIKey ABNQGNFVSFKJGI-UHFFFAOYSA-N

SmilesC1(Cl)=NC=C(C(F)(F)F)C=C1Cl

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2,3-Dichloro-5-(trifluoromethyl)pyridine(69045-84-7) Raman
Mass

MS-IW-4768          
2,3-dichloro-5-(trifluoromethyl)pyridine
C6H2Cl2F3N          (Mass of molecular ion:    215)

   Source Temperature: 210 °C
   Sample Temperature: 150 °C
   Reservoir, 75 eV

      28.0       1.5
      31.0       2.0
      37.0       1.2
      49.0       2.1
      50.0       3.2
      51.0       2.4
      60.0       1.9
      62.0       1.2
      67.0       3.0
      68.0       1.0
      69.0      18.4
      74.0       1.0
      75.0       9.5
      76.0       4.5
      80.5       1.0
      84.0       3.2
      85.0       5.9
      86.0       1.9
      87.0       2.0
      91.0       1.4
      93.0       1.5
      94.0       2.2
      95.0       1.2
      98.0       1.4
      99.0       2.0
     107.5       1.3
     109.0       2.6
     110.0       4.0
     111.0       1.5
     112.0       1.3
     119.0       2.3
     126.0       1.4
     130.0       3.1
     132.0       1.0
     133.0       1.7
     144.0       2.5
     146.0       1.3
     153.0       4.9
     155.0       1.6
     160.0      14.7
     161.0       1.2
     162.0       5.0
     165.0       2.3
     167.0       1.5
     180.0      65.4
     181.0       5.2
     182.0      20.9
     183.0       1.7
     196.0       9.0
     197.0       1.0
     198.0       6.0
     215.0     100.0
     216.0       7.5
     217.0      64.6
     218.0       4.7
     219.0      10.4

400 MHz in CDCl3

2,3-Dichloro-5-(trifluoromethyl)pyridine(69045-84-7) Raman

¹H NMR	399.65 MHz
C₆ H₂ Cl₂ F₃ N	0.05 ml : 0.5 ml CDCl₃
2,3-dichloro-5-(trifluoromethyl)pyridine

    Assign.     Shift(ppm)

      A             8.591
      B             8.034

     Hz     ppm     Int.

   3435.06   8.596    768
   3434.20   8.594    843
   3432.86   8.590    827
   3432.01   8.588    723
   3426.03   8.573     23
   3425.29   8.571     20
   3212.40   8.039   1000
   3211.79   8.037    991
   3211.06   8.035    717
   3210.21   8.033    971
   3209.59   8.032    904
   3203.37   8.016     22
   3202.88   8.015     21

in CDCl3