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返回ChemicalBook首頁>CAS數(shù)據(jù)庫列表>652-29-9更多圖譜> 2',3',4',5',6'-五氟苯乙酮(652-29-9)質(zhì)譜(MS)

652-29-9

2',3',4',5',6'-五氟苯乙酮(652-29-9)質(zhì)譜(MS)

產(chǎn)品名稱:2',3',4',5',6'-五氟苯乙酮

CAS:652-29-9

分子式:C8H3F5O

分子量: 210.1

InChI:InChI=1S/C8H3F5O/c1-2(14)3-4(9)6(11)8(13)7(12)5(3)10/h1H3

InChIKey: FBGHCYZBCMDEOX-UHFFFAOYSA-N

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

  • 圖譜
    Mass 

    MS-IW-1328          
2',3',4',5',6'-pentafluoroacetophenone
C8H3F5O             (Mass of molecular ion:    210)


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


          15.0       2.9
      31.0       3.1
      42.0       3.5
      43.0      42.6
      44.0       1.2
      69.0       1.2
      74.0       1.0
      75.0       1.0
      79.0       2.4
      93.0       5.0
      97.5       1.5
      98.0       3.7
      99.0       2.8
     117.0      16.5
     118.0       1.1
     143.0       1.0
     148.0       2.0
     161.0       2.2
     167.0      34.6
     168.0       4.6
     181.0       2.3
     195.0     100.0
     196.0       7.7
     197.0       3.2
     210.0      33.0
     211.0       2.9

400 MHz in CDCl3

  • 圖譜

    1H NMR 399.65 MHz
    C8 H3 F5 O 0.05 ml : 0.5 ml CDCl3
    2',3',4',5',6'-pentafluoroacetophenone
    ChemicalStructure 
        Assign.     Shift(ppm)
    
      A             2.644
  

         Hz     ppm     Int.


       1058.84   2.650    720
   1056.88   2.645   1000
   1055.05   2.640    674

liquid film

  • 圖譜

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