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622-56-0

肉豆蔻醯苯胺(622-56-0)紅外圖譜(IR2)

產(chǎn)品名稱:肉豆蔻醯苯胺

CAS:622-56-0

分子式:C20H33NO

分子量: 303.48

InChI:InChI=1S/C20H33NO/c1-2-3-4-5-6-7-8-9-10-11-15-18-20(22)21-19-16-13-12-14-17-19/h12-14,16-17H,2-11,15,18H2,1H3,(H,21,22)

InChIKey: LYSJUAWWUBVYCB-UHFFFAOYSA-N

Smiles:C(NC1=CC=CC=C1)(=O)CCCCCCCCCCCCC

  • 圖譜
    Mass 

    MS-NW-1948          
tetradacananilide
C20H33NO            (Mass of molecular ion:    303)


       Source Temperature: 200 °C
   Sample Temperature: 120 °C
   Direct, 75 eV


          29.0       2.6
      41.0       5.6
      43.0       7.4
      55.0       4.0
      57.0       4.8
      65.0       1.4
      66.0       1.1
      69.0       1.7
      71.0       1.9
      77.0       2.1
      85.0       1.0
      92.0       2.8
      93.0     100.0
      94.0      11.1
      95.0       1.0
     120.0       2.2
     135.0      18.9
     136.0       1.8
     148.0       1.7
     303.0       6.2
     304.0       1.3

90 MHz in CDCl3

  • 圖譜

    1H NMR 89.56 MHz
    C20 H33 N O 0.027 g : 0.5 ml CDCl3
    tetradacananilide
    ChemicalStructure 
        Assign.     Shift(ppm)
    
      A             7.49
      B             7.47
      C             7.29
      D             7.093
      E             2.325
      F             1.70
      G             1.25
      J             0.882
  

         Hz     ppm     Int.


        676.50   7.554     32
    670.94   7.492     36
    669.31   7.474     61
    668.25   7.462     61
    660.88   7.380     24
    659.56   7.365     35
    652.63   7.288     74
    650.88   7.268     23
    644.94   7.202     35
    639.38   7.140     32
    632.50   7.063     30
    209.75   2.343     50
    201.69   2.253     41
    112.31   1.255   1000
     83.81   0.936     30
     78.69   0.879     97
     72.50   0.810     21

in CDCl3

  • 圖譜

CCl4 solution

  • 圖譜

KBr disc

  • 圖譜

4880 A,200 M,powder

  • 圖譜

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