13CNMR)的核磁圖,紅外圖譜,Raman光譜,質(zhì)譜等圖譜" /> 13CNMR)" />

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返回ChemicalBook首頁(yè)>CAS數(shù)據(jù)庫(kù)列表>88419-56-1更多圖譜> 2,4,5-三氟苯甲酰氯(88419-56-1)核磁圖(13CNMR)

88419-56-1

2,4,5-三氟苯甲酰氯(88419-56-1)核磁圖(13CNMR)

產(chǎn)品名稱(chēng):2,4,5-三氟苯甲酰氯

CAS:88419-56-1

分子式:C7H2ClF3O

分子量: 194.54

InChI:InChI=1S/C7H2ClF3O/c8-7(12)3-1-5(10)6(11)2-4(3)9/h1-2H

InChIKey: STBGCAUUOPNJBH-UHFFFAOYSA-N

Smiles:C(Cl)(=O)C1=CC(F)=C(F)C=C1F

  • 圖譜
    Mass 

    MS-IW-9722          
2,4,5-trifluorobenzoyl chloride
C7H2ClF3O           (Mass of molecular ion:    194)


       Source Temperature: 230 °C
   Sample Temperature: 150 °C
   Reservoir, 75 eV


          28.0       2.5
      31.0       5.0
      36.0       1.5
      37.0       1.7
      50.0       1.0
      56.0       1.7
      57.0       1.2
      61.0       3.7
      62.0       3.6
      68.0       1.7
      74.0       1.0
      75.0       3.5
      79.0       1.1
      79.5       6.2
      80.0       4.1
      81.0      29.2
      82.0       1.6
      87.0       1.1
      92.0       1.1
      99.0       2.3
     112.0       1.5
     130.0       2.0
     131.0      41.1
     132.0       2.9
     157.0       1.3
     159.0     100.0
     160.0       7.6
     176.0       1.5
     194.0       3.5
     196.0       1.1

400 MHz in CDCl3

  • 圖譜

    1H NMR 399.65 MHz
    C7 H2 Cl F3 O 0.05 ml : 0.5 ml CDCl3
    2,4,5-trifluorobenzoyl chloride
    ChemicalStructure 
        Assign.     Shift(ppm)
    
      A             8.007
      B             7.120
  

         Hz     ppm     Int.


       3212.77   8.039    493
   3212.40   8.039    495
   3206.18   8.023    537
   3205.81   8.022    536
   3204.22   8.018    564
   3203.86   8.017    554
   3202.64   8.014    564
   3202.27   8.013    550
   3197.63   8.002    559
   3197.27   8.001    549
   3196.04   7.998    573
   3195.68   7.997    553
   3194.09   7.993    544
   3187.50   7.976    505
   2858.64   7.153    514
   2858.28   7.152    505
   2852.42   7.138    556
   2848.75   7.129    983
   2845.46   7.120    114
   2842.53   7.113   1000
   2838.87   7.104    540
   2833.01   7.089    566

in CDCl3

  • 圖譜

liquid film

  • 圖譜

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