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59-50-7

4-氯-3-甲基苯酚(59-50-7)紅外圖譜(IR1)

產(chǎn)品名稱:4-氯-3-甲基苯酚

CAS:59-50-7

分子式:C7H7ClO

分子量: 142.58

InChI:InChI=1S/C7H7ClO/c1-5-4-6(9)2-3-7(5)8/h2-4,9H,1H3

InChIKey: CFKMVGJGLGKFKI-UHFFFAOYSA-N

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

  • 圖譜


        Assign.     Shift(ppm)
    
      A             7.152
      B             6.688
      C             6.600
      D             5.15
      E             2.289
     
     J(A,C)=8.4HZ
     J(B,C)=3.1HZ
     J(B,A)=J(B,E)=0.7HZ
     J(C,E)=0.5HZ
     400MHZ : HSP-43-728
    Spectral Code: 1H NMR : 90 MHz in CDCl3

  • 圖譜


           ppm   Int.  Assign.
    
      153.46   915      1
      137.52   711      2
      129.92  1000      3
      126.30   522      4
      117.88   826      5
      114.17   826      6
       20.07   512      7
    Spectral Code: 13C NMR : in CDCl3

  • 圖譜

  • 圖譜

    Spectral Code: Raman : 4880 A,100M,powder

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