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返回ChemicalBook首页>CAS数据库列表>542-02-9更多图谱> 6-甲基-1,3,5-三嗪-2,4-二胺(542-02-9)红外图谱(IR1)

542-02-9

6-甲基-1,3,5-三嗪-2,4-二胺(542-02-9)红外图谱(IR1)

分子式:C4H7N5

分子量: 125.13

InChI:InChI=1S/C4H7N5/c1-2-7-3(5)9-4(6)8-2/h1H3,(H4,5,6,7,8,9)

InChIKey: NJYZCEFQAIUHSD-UHFFFAOYSA-N

Smiles:N1=C(C)N=C(N)N=C1N

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    Mass

    MS-NW-0250          
    6-methyl-1,3,5-triazine-2,4-diamine
    C4H7N5              (Mass of molecular ion:    125)
    

       Source Temperature: 200 °C
       Sample Temperature:   0 °C
       Direct, 75 eV
    

          15.0       3.0
          18.0       1.8
          27.0       1.4
          28.0       6.8
          40.0       2.1
          41.0       4.0
          42.0      24.5
          43.0      57.5
          44.0       1.0
          53.0       1.4
          55.0       2.5
          58.0       1.1
          67.0       1.2
          68.0       6.0
          82.0       1.7
          83.0       6.9
          84.0       7.0
          85.0       2.7
          98.0       8.3
         110.0       2.0
         125.0     100.0
         126.0       9.6
    

400 MHz in DMSO-d6

90 MHz in DMSO-d6

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    1H NMR 399.65 MHz
    C4 H7 N5 saturated in DMSO-d6
    6-methyl-1,3,5-triazine-2,4-diamine
    ChemicalStructure
        Assign.     Shift(ppm)
    A 6.6 B 2.064

         Hz     ppm     Int.
    

       2651.86   6.636     38
        825.20   2.065   1000
    

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    1H NMR 89.56 MHz
    C4 H7 N5 0.044 g : 0.5 ml DMSO-d6
    6-methyl-1,3,5-triazine-2,4-diamine
    ChemicalStructure
        Assign.     Shift(ppm)
    A 6.61 B 2.066

         Hz     ppm     Int.
    

        591.58   6.606    236
        185.08   2.067   1000
    

in DMSO-d6

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KBr disc

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nujol mull

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