697-73-4

2,6-Difluorobenzyl chloride(697-73-4) ¹³C NMR

Product Name2,6-Difluorobenzyl chloride

CAS 697-73-4

Molecular FormulaC7H5ClF2

Molecular Weight162.56

InChIInChI=1S/C7H5ClF2/c8-4-5-6(9)2-1-3-7(5)10/h1-3H,4H2

InChIKey MJXRENZUAQXZGJ-UHFFFAOYSA-N

SmilesC1(F)=CC=CC(F)=C1CCl

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¹HNMR

¹³CNMR

IR1

2,6-Difluorobenzyl chloride(697-73-4) <sup>13</sup>C NMR
Mass

MS-IW-7544          
alpha-chloro-2,6-difluorotoluene
C7H5ClF2            (Mass of molecular ion:    162)

   Source Temperature: 220 °C
   Sample Temperature: 150 °C
   Reservoir, 75 eV

      31.0       1.2
      50.0       1.5
      51.0       2.1
      53.0       1.0
      57.0       3.4
      61.0       1.2
      62.0       1.2
      63.0       2.1
      63.5       2.0
      71.0       1.5
      75.0       2.9
      77.0       3.9
      81.0       3.4
     101.0       8.4
     107.0       5.1
     125.0       4.7
     126.0       2.1
     127.0     100.0
     128.0       8.0
     161.0       3.1
     162.0      20.6
     163.0       2.5
     164.0       6.6

400 MHz in CDCl3

2,6-Difluorobenzyl chloride(697-73-4) <sup>13</sup>C NMR

¹H NMR	399.65 MHz
C₇ H₅ Cl F₂	0.043 g : 0.5 ml CDCl₃
alpha-chloro-2,6-difluorotoluene

    Assign.     Shift(ppm)

      A             7.299
      B             6.917
      C             4.666

     Hz     ppm     Int.

   2932.62   7.338     64
   2926.15   7.322    128
   2924.19   7.317    124
   2919.68   7.306     84
   2917.72   7.301    258
   2915.77   7.296    101
   2911.25   7.285    126
   2909.30   7.280    158
   2902.83   7.264     82
   2777.10   6.949     51
   2775.51   6.945     68
   2771.97   6.936    360
   2768.55   6.928     84
   2767.09   6.924     95
   2764.40   6.918    429
   2761.23   6.910    112
   2759.64   6.906     85
   2756.23   6.897    323
   2752.69   6.888     67
   2751.34   6.885     53
   1864.75   4.666   1000

in CDCl3