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811-98-3

氘代甲醇(811-98-3)红外图谱(IR1)

产品名称:氘代甲醇

CAS:811-98-3

分子式:CD4O

分子量: 36.07

InChI:InChI=1S/CH4O/c1-2/h2H,1H3/i1D3,2D

InChIKey: OKKJLVBELUTLKV-MZCSYVLQSA-N

Smiles:C([2H])([2H])([2H])O[2H]

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    Mass

    MS-NW-6800          
    methanol-d4
    CD4O                (Mass of molecular ion:     36)
    

       Source Temperature: 260 °C
       Sample Temperature: 190 °C
       Reservoir, 75 eV
    

          14.0       1.5
          16.0       4.6
          18.0      30.0
          28.0       6.8
          29.0       3.5
          30.0      50.7
          31.0       2.3
          32.0       5.8
          33.0      60.5
          34.0     100.0
          35.0      48.0
          36.0      70.6
    

90 MHz in CDCl3

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    1H NMR 89.56 MHz
    C D4 O 50 VOL% in CDCl3
    methanol-d4
    ChemicalStructure
        Assign.     Shift(ppm)
    A 4.57 B 3.35 A-PEAK INCLUDES H2O.

         Hz     ppm     Int.
    

        413.56   4.618     63
        409.75   4.576    867
        409.00   4.567   1000
        408.31   4.560    845
        405.00   4.523     85
        404.56   4.518     72
        404.19   4.514     70
        403.50   4.506     57
        302.94   3.383    140
        301.69   3.369    232
        301.06   3.362    202
        299.94   3.350    320
        298.38   3.332    248
        296.69   3.313    141
        295.75   3.303     81
        295.38   3.299     61
        294.88   3.293     61
    

in CDCl3

in Neat

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liquid film

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