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2004-03-7

6-甲基嘌呤(2004-03-7)紅外圖譜(IR2)

產(chǎn)品名稱:6-甲基嘌呤

CAS:2004-03-7

分子式:C6H6N4

分子量: 134.14

InChI:InChI=1S/C6H6N4/c1-4-5-6(9-2-7-4)10-3-8-5/h2-3H,1H3,(H,7,8,9,10)

InChIKey: SYMHUEFSSMBHJA-UHFFFAOYSA-N

Smiles:N1C2C(=NC=NC=2C)NC=1

400 MHz in DMSO-d6

90 MHz in D2O

  • 圖譜

    1H NMR 399.65 MHz
    C6 H6 N4 0.040 g : 0.5 ml DMSO-d6
    6-methylpurine
    ChemicalStructure 
        Assign.     Shift(ppm)
    
      A             8.798
      B             8.595
      C             2.760
  

         Hz     ppm     Int.


       3516.36   8.799    331
   3435.06   8.596    335
   1103.03   2.760   1000

  • 圖譜

    1H NMR 89.56 MHz
    C6 H6 N4 0.034 g : 0.5 ml D2O
    6-methylpurine
    ChemicalStructure 
        Assign.     Shift(ppm)
    
      A             8.391
      B             8.295
      D             2.521
     
     THE SOLVENT SIGNAL REMOVED.
  

         Hz     ppm     Int.


        751.56   8.392    363
    749.06   8.364     26
    747.13   8.343     27
    743.00   8.297    414
    225.81   2.522   1000

in DMSO-d6

in D2O

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KBr disc

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nujol mull

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