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Back ChemicalBook Home>CAS DataBase List>3002-81-1More Spectrum> 5,6-Dimethyl-1,10-phenanthroline(3002-81-1) IR1

5,6-Dimethyl-1,10-phenanthroline(3002-81-1) IR1

Molecular FormulaC14H12N2

Molecular Weight208.26

InChIInChI=1S/C14H12N2/c1-9-10(2)12-6-4-8-16-14(12)13-11(9)5-3-7-15-13/h3-8H,1-2H3

InChIKey BRPQDJPJBCQFSR-UHFFFAOYSA-N

SmilesN1C2C(=C(C)C(C)=C3C=2N=CC=C3)C=CC=1


  • Mass

    MS-KW-0504          
    5,6-dimethyl-1,10-phenanthroline
    C14H12N2            (Mass of molecular ion:    208)
    

       Source Temperature: 170 °C
       Sample Temperature: 150 °C
       Direct, 75 eV
    

          39.0       1.9
          50.0       1.3
          51.0       2.8
          62.0       1.0
          63.0       3.6
          64.0       1.0
          69.5       2.7
          75.0       2.6
          75.5       1.5
          76.0       4.6
          76.5       2.0
          77.0       4.2
          78.0       1.2
          82.5       3.4
          83.0       4.4
          83.5       1.1
          88.5       1.2
          89.0       4.4
          89.5       4.8
          90.0       4.5
          90.5       1.5
          91.0       1.3
          96.0       3.6
          96.5       4.3
         102.0       2.8
         102.5       1.1
         103.0       6.0
         103.5       1.6
         104.0       8.6
         104.5       1.3
         126.0       1.0
         127.0       1.7
         138.0       1.0
         139.0       2.1
         140.0       2.4
         151.0       2.5
         152.0       4.0
         153.0       1.8
         154.0       1.7
         164.0       2.3
         165.0       2.4
         166.0       4.7
         167.0       2.9
         168.0       1.1
         177.0       1.4
         178.0       2.9
         179.0       3.2
         180.0       4.3
         181.0       3.2
         191.0       2.1
         192.0      14.1
         193.0      86.7
         194.0      12.9
         195.0       1.0
         205.0       9.3
         206.0       4.2
         207.0      20.8
         208.0     100.0
         209.0      16.2
         210.0       1.2
    

90 MHz in CDCl3


  • 1H NMR 89.56 MHz
    C14 H12 N2 0.030 g : 0.5 ml CDCl3
    5,6-dimethyl-1,10-phenanthroline
    ChemicalStructure
        Assign.     Shift(ppm)
    A 9.091 B 8.305 C 7.557 D 2.574 J(A,B)=1.7HZ. J(A,C)=4.3HZ. J(B,C)=8.4HZ.

         Hz     ppm     Int.
    

        817.25   9.126     78
        815.56   9.107     85
        812.94   9.078     84
        811.31   9.059     90
        749.31   8.367     72
        747.69   8.349     73
        740.94   8.274     93
        739.25   8.255     89
        682.69   7.623    128
        678.38   7.575    121
        674.25   7.529    103
        670.00   7.482     97
        230.56   2.575   1000
    

in CDCl3



KBr disc





5,6-Dimethyl-1,10-phenanthroline(3002-81-1) IR1 Atlas of Related Products

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