60811-21-4

3-氯-4-氟溴苯(60811-21-4)红外图谱(IR1)

产品名称:3-氯-4-氟溴苯

CAS:60811-21-4

分子式:C6H3BrClF

分子量: 209.44

InChI:InChI=1S/C6H3BrClF/c7-4-1-2-6(9)5(8)3-4/h1-3H

InChIKey: CJTIWGBQCVYTQE-UHFFFAOYSA-N

Smiles:C1(F)=CC=C(Br)C=C1Cl

¹HNMR

¹³CNMR

IR1

Mass

MS-IW-9543          
4-bromo-2-chloro-1-fluorobenzene
C6H3BrClF           (Mass of molecular ion:    208)

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

      31.0       2.8
      36.0       1.4
      37.0       4.1
      38.0       2.1
      47.0       1.5
      49.0       2.1
      50.0       9.2
      56.0       1.0
      61.0       4.3
      62.0       3.5
      63.0       3.7
      64.0       3.6
      65.0       1.1
      68.0       8.7
      69.0       1.8
      73.0       3.5
      74.0      11.8
      75.0       3.8
      84.0       1.7
      86.0       1.8
      87.0       1.5
      92.0       4.3
      93.0      16.4
      94.0      18.3
      95.0       1.6
     103.0       1.2
     104.0       6.3
     105.0       7.9
     106.0       1.9
     109.0      12.3
     110.0       1.1
     111.0       4.1
     128.0       3.4
     129.0      82.1
     130.0       6.9
     131.0      26.3
     132.0       1.8
     208.0      77.0
     209.0       5.3
     210.0     100.0
     211.0       6.6
     212.0      23.9
     213.0       1.6

400 MHz in CDCl3

¹H NMR	399.65 MHz
C₆ H₃ Br Cl F	0.05 ml : 0.5 ml CDCl₃
4-bromo-2-chloro-1-fluorobenzene

    Assign.     Shift(ppm)

      A             7.507
      B             7.319
      C             6.998

     Hz     ppm     Int.

   3004.76   7.519    580
   3002.32   7.513    610
   2998.17   7.502    580
   2995.73   7.496    598
   2936.28   7.348     26
   2933.23   7.340    339
   2930.79   7.334    333
   2928.96   7.329    351
   2926.51   7.323    329
   2924.44   7.318    387
   2922.00   7.312    373
   2920.17   7.307    381
   2917.72   7.301    346
   2809.20   7.030     27
   2805.42   7.020    597
   2802.98   7.014     43
   2796.75   6.998   1000
   2790.41   6.983     43
   2787.96   6.977    528

in CDCl3