811-98-3

Methanol-d4(811-98-3) IR1

Product NameMethanol-d4

CAS 811-98-3

Molecular FormulaCD4O

Molecular Weight36.07

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

InChIKey OKKJLVBELUTLKV-MZCSYVLQSA-N

SmilesC([2H])([2H])([2H])O[2H]

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Methanol-d4(811-98-3) IR1
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

Methanol-d4(811-98-3) IR1

¹H NMR	89.56 MHz
C D₄ O	50 VOL% in CDCl₃
methanol-d₄

    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