ChemicalBook
English   Japanese   Germany   Korea
返回ChemicalBook首页>CAS数据库列表>2613-23-2更多图谱> 3-氯-4-氟苯酚(2613-23-2)红外图谱(IR1)

2613-23-2

3-氯-4-氟苯酚(2613-23-2)红外图谱(IR1)

产品名称:3-氯-4-氟苯酚

CAS:2613-23-2

分子式:C6H4ClFO

分子量: 146.55

InChI:InChI=1S/C6H4ClFO/c7-5-3-4(9)1-2-6(5)8/h1-3,9H

InChIKey: ZQXLIXHVJVAPLW-UHFFFAOYSA-N

Smiles:C1(O)=CC=C(F)C(Cl)=C1

  • 图谱
    Mass

    MS-NW-9906          
    3-chloro-4-fluorophenol
    C6H4ClFO            (Mass of molecular ion:    146)
    

       Source Temperature: 250 °C
       Sample Temperature: 160 °C
       Reservoir, 75 eV
    

          31.0       2.6
          37.0       1.1
          49.0       1.1
          50.0       1.4
          53.0       1.5
          55.0       1.9
          56.0       2.6
          57.0       8.9
          61.0       2.4
          62.0       2.1
          63.0       6.6
          67.0       1.4
          73.0       4.8
          74.0       2.1
          81.0       6.0
          82.0      10.7
          83.0      39.4
          84.0       2.5
          91.0       2.4
          93.0       1.5
          98.0       1.7
         110.0       1.5
         111.0       2.5
         117.0       6.0
         118.0       5.4
         119.0       2.2
         120.0       1.9
         126.0       1.0
         145.0       1.8
         146.0     100.0
         147.0       7.2
         148.0      32.6
         149.0       2.1
    

400 MHz in CDCl3

  • 图谱

    1H NMR 399.65 MHz
    C6 H4 Cl F O 0.037 g : 0.5 ml CDCl3
    3-chloro-4-fluorophenol
    ChemicalStructure
        Assign.     Shift(ppm)
    A 6.999 B 6.888 C 6.688 D 5.27

         Hz     ppm     Int.
    

       2806.52   7.023    510
       2803.10   7.014     26
       2797.61   7.001   1000
       2794.56   6.993     34
       2793.58   6.991     31
       2788.94   6.979    584
       2785.77   6.971     22
       2784.91   6.969     23
       2757.45   6.900    541
       2754.39   6.893    596
       2751.46   6.885    561
       2748.41   6.878    582
       2680.30   6.707    336
       2677.25   6.699    493
       2673.58   6.690    325
       2671.39   6.685    311
       2668.33   6.677    435
       2664.67   6.668    275
       2106.93   5.272     99
    

in CDCl3

  • 图谱

KBr disc

  • 图谱

nujol mull

  • 图谱

  • 图谱

×