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Back ChemicalBook Home>CAS DataBase List>2959-96-8More Spectrum> 2-PHENYLGLUTARIC ANHYDRIDE(2959-96-8) IR1

2-PHENYLGLUTARIC ANHYDRIDE(2959-96-8) IR1

Molecular FormulaC11H10O3

Molecular Weight190.2

InChIInChI=1S/C11H10O3/c12-10-7-6-9(11(13)14-10)8-4-2-1-3-5-8/h1-5,9H,6-7H2

InChIKey NVPRNSAYSSEIGR-UHFFFAOYSA-N

SmilesC1(=O)OC(=O)CCC1C1=CC=CC=C1


  • Mass

    MS-NW-6854          
    2-phenylglutaric anhydride
    C11H10O3            (Mass of molecular ion:    190)
    

       Source Temperature: 250 °C
       Sample Temperature: 130 °C
       Direct, 75 eV
    

          18.0       2.7
          26.0       1.5
          27.0       9.5
          28.0       2.3
          29.0       3.8
          31.0       1.4
          38.0       3.3
          39.0      22.1
          40.0       2.1
          41.0       9.3
          42.0       2.8
          43.0       6.7
          45.0      14.5
          50.0       7.8
          51.0      20.2
          52.0       5.5
          53.0       3.1
          55.0       5.9
          57.0       2.3
          57.5       2.4
          58.0       2.6
          60.0       6.1
          61.0       1.3
          62.0       4.9
          63.0      14.3
          64.0       3.6
          65.0      13.2
          66.0       1.4
          73.0       1.3
          74.0       3.1
          75.0       3.1
          76.0       3.1
          77.0      32.4
          78.0      17.5
          79.0      27.5
          80.0       1.9
          85.0       1.3
          86.0       1.2
          87.0       1.7
          89.0      14.0
          90.0      12.5
          91.0      52.8
          92.0       5.5
          94.0       1.0
         102.0       4.6
         103.0      48.0
         104.0      97.2
         105.0      25.6
         106.0       2.1
         107.0      10.2
         115.0      31.6
         116.0      10.9
         117.0      99.9
         118.0      20.1
         119.0       2.3
         120.0       3.2
         121.0       6.6
         127.0       5.1
         131.0       3.9
         133.0       2.0
         134.0       1.4
         135.0       2.8
         136.0       1.3
         144.0       4.4
         145.0       4.9
         146.0       5.7
         147.0       1.6
         148.0     100.0
         149.0      10.9
         150.0       1.0
         162.0      16.1
         163.0       5.5
         164.0       1.7
         190.0      90.4
         191.0      11.7
         192.0       1.3
         208.0       1.2
    

90 MHz in CDCl3


  • 1H NMR 89.56 MHz
    C11 H10 O3 0.046 g : 0.5 ml CDCl3
    2-phenylglutaric anhydride
    ChemicalStructure
        Assign.     Shift(ppm)
    A 7.30 B 3.64 C 2.58 to 1.87

         Hz     ppm     Int.
    

        653.50   7.297   1000
        648.50   7.241     26
        326.38   3.645     71
        211.13   2.358     82
        208.06   2.324    141
        205.81   2.299     54
        204.31   2.282     86
        203.63   2.274     85
        203.31   2.271     84
        200.56   2.240     40
        199.63   2.230     47
        198.50   2.217     39
        190.06   2.123     30
    

KBr disc



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