2,6-Dimethylfluorobenzene(443-88-9) ¹³C NMR

Product Name2,6-Dimethylfluorobenzene

CAS 443-88-9

Molecular FormulaC8H9F

Molecular Weight124.16

InChIInChI=1S/C8H9F/c1-6-4-3-5-7(2)8(6)9/h3-5H,1-2H3

InChIKey JTAUTNBVFDTYTI-UHFFFAOYSA-N

SmilesC1(C)=CC=CC(C)=C1F

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¹HNMR

¹³CNMR

FT-IR

Mass

MS-KW-0549          
2-fluoro-m-xylene
C8H9F               (Mass of molecular ion:    124)

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

      27.0       1.9
      39.0       3.4
      50.0       2.3
      51.0       7.0
      52.0       1.1
      57.0       3.3
      60.0       1.5
      61.0       3.3
      62.0       1.3
      63.0       2.8
      70.0       1.3
      74.0       1.1
      75.0       2.6
      77.0       8.3
      78.0       1.5
      81.0       1.5
      83.0       4.8
      95.0       2.1
      96.0       4.0
      97.0       2.8
     101.0       3.8
     102.0       1.5
     103.0       5.6
     107.0       1.5
     109.0     100.0
     110.0       7.5
     121.0       2.6
     122.0       2.7
     123.0      31.3
     124.0      56.3
     125.0       4.7

400 MHz in CDCl3

¹H NMR	399.65 MHz
C₈H₉F	0.05 ml : 0.5 ml CDCl₃
2-fluoro-1,3-dimethylbenzene

    Assign.     Shift(ppm)

     A           6.960
     B           6.883
     C           2.238

     Hz     ppm     Int.

   2790.90   6.982    119
   2790.53   6.981    116
   2783.45   6.963    264
   2776.25   6.945    184
   2775.88   6.944    182
   2757.45   6.898    184
   2750.74   6.881    115
   2749.15   6.877    120
   2742.56   6.861     74
    895.63   2.241   1000
    893.32   2.235    933

in CDCl3