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541-85-5

5-METHYL-3-HEPTANONE

Product Name 5-METHYL-3-HEPTANONE

CAS541-85-5

MFC8H16O

MW128.21

More

  • 541-85-5_ms_1
    Mass

    MS-NW-0713          
    5-methyl-3-heptanone
    C8H16O              (Mass of molecular ion:    128)
    

       Source Temperature: 210 °C
       Sample Temperature: 150 °C
       Reservoir, 75 eV
    

          14.0       1.2
          15.0       1.6
          18.0       1.5
          26.0       2.1
          27.0      25.6
          28.0       9.8
          29.0      70.4
          30.0       1.6
          39.0      14.5
          40.0       2.2
          41.0      32.4
          42.0       9.5
          43.0      99.6
          44.0       3.5
          51.0       1.4
          53.0       3.2
          54.0       1.4
          55.0      11.3
          56.0       7.3
          57.0     100.0
          58.0       3.6
          69.0       2.3
          70.0       1.5
          71.0      87.9
          72.0      82.4
          73.0      18.9
          74.0       1.0
          81.0       1.3
          85.0       1.6
          99.0      66.0
         100.0       4.7
         128.0      25.8
         129.0       2.6
    

90 MHz in CDCl3

  • 541-85-5_1hnmr_0

    1H NMR 89.56 MHz
    C8 H16 O 0.04 ml : 0.5 ml CDCl3
    5-methyl-3-heptanone
    ChemicalStructure
        Assign.     Shift(ppm)
    A 2.45 B 2.26 C 1.92 D 1.26 E 1.05 F 0.88 G 0.87

         Hz     ppm     Int.
    

        219.31   2.449    258
        212.06   2.368    368
        206.00   2.301    256
        198.81   2.220    222
        190.69   2.130     60
        183.31   2.047     64
        176.06   1.966     45
        169.56   1.894     51
        163.25   1.823     38
        121.69   1.359     70
        117.63   1.314     90
        113.88   1.272     90
        112.38   1.255     81
        110.81   1.238    113
        108.44   1.211     73
        107.25   1.198     67
        105.00   1.173     65
        103.81   1.160     98
        100.81   1.126    391
         93.75   1.047   1000
         86.19   0.963    391
         85.75   0.958    359
         85.06   0.950    328
         81.94   0.915    740
         78.50   0.877    316
         77.88   0.870    352
         75.56   0.844    653
    

in CDCl3

  • 541-85-5_13cnmr_0

CCl4 solution

  • 541-85-5_ir1_2

liquid film

  • 541-85-5_ir2_1

4880 A,200 M,liquid

  • 541-85-5_raman_0