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Back ChemicalBook Home>CAS DataBase List>91-73-6More Spectrum> N,N-DIBENZYLANILINE(91-73-6) MS

N,N-DIBENZYLANILINE(91-73-6) MS

Product NameN,N-DIBENZYLANILINE

CAS91-73-6

Molecular FormulaC20H19N

Molecular Weight273.37

InChIInChI=1S/C20H19N/c1-4-10-18(11-5-1)16-21(20-14-8-3-9-15-20)17-19-12-6-2-7-13-19/h1-15H,16-17H2

InChIKey ISGXOWLMGOPVPB-UHFFFAOYSA-N

SmilesC1(CN(C2=CC=CC=C2)CC2=CC=CC=C2)=CC=CC=C1


  • Mass

    MS-NW-0402          
    N-phenyldibenzylamine
    C20H19N             (Mass of molecular ion:    273)
    

       Source Temperature: 180 °C
       Sample Temperature: 140 °C
       Direct, 75 eV
    

          39.0       2.9
          51.0       5.0
          63.0       1.4
          65.0       9.3
          77.0      16.5
          78.0       2.0
          89.0       1.6
          91.0     100.0
          92.0      10.8
         104.0       8.4
         105.0       2.5
         165.0       1.0
         179.0       1.0
         180.0       6.9
         181.0      14.6
         182.0      21.5
         183.0       3.3
         194.0       3.1
         196.0      23.0
         197.0       3.6
         272.0       4.1
         273.0      54.3
         274.0      12.1
         275.0       1.2
    

90 MHz in CDCl3


  • 1H NMR 89.56 MHz
    C20 H19 N 0.047 g : 0.5 ml CDCl3
    N-phenyldibenzylamine
    ChemicalStructure
        Assign.     Shift(ppm)
    A 7.23 B 7.13 C 6.76 D 6.66 E 4.593

         Hz     ppm     Int.
    

        651.56   7.276     50
        650.81   7.267     73
        649.50   7.253    146
        647.81   7.234   1000
        643.19   7.182     54
        641.88   7.168     66
        640.31   7.150    121
        639.13   7.137     70
        638.56   7.130     72
        638.00   7.124     77
        633.69   7.076     38
        632.13   7.059     47
        631.63   7.053     74
        631.00   7.046     85
        609.19   6.803     46
        608.06   6.790    113
        605.63   6.763     31
        604.69   6.752     48
        603.94   6.744     34
        602.44   6.727     34
        601.56   6.717     34
        600.38   6.704     59
        599.25   6.692     54
        598.50   6.683     37
        596.63   6.662     55
        411.38   4.594    451
    

in CDCl3



KBr disc



nujol mull



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