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101-01-9

三苯基胍(101-01-9)红外图谱(IR2)

产品名称:三苯基胍

CAS:101-01-9

分子式:C19H17N3

分子量: 287.36

InChI:InChI=1S/C19H17N3/c1-4-10-16(11-5-1)20-19(21-17-12-6-2-7-13-17)22-18-14-8-3-9-15-18/h1-15H,(H2,20,21,22)

InChIKey: FUPAJKKAHDLPAZ-UHFFFAOYSA-N

Smiles:N(C1=CC=CC=C1)/C(=N\C1=CC=CC=C1)/NC1=CC=CC=C1

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    Mass

    MS-IW-2152          
    1,2,3-triphenylguanidine
    C19H17N3            (Mass of molecular ion:    287)
    

       Source Temperature: 180 °C
       Sample Temperature: 170 °C
       Direct, 75 eV
    

          28.0       1.0
          38.0       1.5
          39.0       4.5
          40.0       1.0
          41.0       1.2
          46.5       1.4
          50.0       2.7
          51.0      11.2
          52.0       2.0
          63.0       3.1
          64.0       4.3
          65.0       7.8
          66.0      10.6
          67.0       1.2
          76.0       2.8
          77.0      23.6
          78.0       2.1
          90.0       1.3
          91.0      13.5
          92.0       7.2
          93.0      40.8
          94.0       2.9
          97.0       2.8
         103.0       3.4
         104.0       2.8
         118.0       2.9
         119.0       1.2
         166.0       1.2
         167.0       1.4
         168.0       1.1
         193.0       4.8
         194.0     100.0
         195.0      19.5
         196.0       1.7
         286.0       2.0
         287.0       6.0
         288.0       1.2
    

400 MHz in CDCl3

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    1H NMR 399.65 MHz
    C19 H17 N3 0.031 g : 0.5 ml CDCl3
    1,2,3-triphenylguanidine
    ChemicalStructure
        Assign.     Shift(ppm)
    A 7.29 B 7.19 C 7.03 D 5.93

         Hz     ppm     Int.
    

       2941.89   7.362     21
       2941.53   7.361     21
       2941.16   7.360     21
       2940.06   7.357     23
       2939.09   7.355     23
       2938.72   7.354     24
       2935.30   7.345     30
       2920.17   7.307    463
       2912.23   7.287   1000
       2904.79   7.269    741
       2892.21   7.237    189
       2873.78   7.191    382
       2810.30   7.032    291
       2779.66   6.956     21
       2365.36   5.919     62
    

in CDCl3

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KBr disc

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nujol mull

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