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2037-26-5

氘代甲苯(2037-26-5)Raman光譜

產(chǎn)品名稱:氘代甲苯

CAS:2037-26-5

分子式:C7D8

分子量: 100.19

InChI:InChI=1S/C7H8/c1-7-5-3-2-4-6-7/h2-6H,1H3/i1D3,2D,3D,4D,5D,6D

InChIKey: YXFVVABEGXRONW-JGUCLWPXSA-N

Smiles:C1(C([2H])([2H])[2H])=C([2H])C(=C([2H])C([2H])=C1[2H])[2H]

  • 圖譜
    Mass 

    MS2019-05607CM      
toluene-d8
C7D8                (Mass of molecular ion:    100)


       Source Temperature: 250 °C
   Sample Temperature: 250 °C
   Reservoir, 70 eV


          14.0       1.6
      18.0       3.1
      28.0       8.1
      30.0       7.3
      38.0       2.9
      40.0       7.6
      42.0      24.9
      44.0       2.5
      46.0       2.2
      48.0       5.2
      49.0       1.7
      50.0       4.1
      52.0       9.7
      54.0      14.9
      56.0       2.7
      58.0       1.5
      62.0       1.9
      64.0       4.0
      66.0       9.4
      68.0       1.8
      70.0      15.1
      72.0       1.5
      76.0       1.5
      82.0       1.9
      94.0       2.8
      96.0       1.3
      97.0       5.7
      98.0     100.0
      99.0      13.0
     100.0      82.7
     101.0       6.4

400 MHz neat

  • 圖譜

    1H NMR 399.65 MHz
    C7 D8 neat
    toluene-d8
    ChemicalStructure 
        Assign.     Shift(ppm)
    
      A             7.10
      B             7.01
      C             6.98
      D             2.087
  

         Hz     ppm     Int.


       2836.30   7.097    404
   2835.33   7.095    365
   2803.71   7.016    194
   2802.73   7.013    189
   2798.58   7.003     35
   2797.85   7.001     32
   2797.24   7.000     32
   2795.90   6.996     32
   2795.04   6.994     37
   2788.21   6.977   1000
   2787.23   6.975    983
    838.62   2.099    166
    836.43   2.093    340
    834.23   2.088    499
    831.91   2.082    365
    829.71   2.077    196

neat

  • 圖譜

Liquid film

  • 圖譜

  • 圖譜

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