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网站主页CAS数据库列表 628-05-7更多图谱1-硝基戊烷(628-05-7)Raman光谱

1-硝基戊烷

产品名称 1-硝基戊烷

CAS号628-05-7

分子式C5H11NO2

分子量117.15


  • Mass

    MS-NW-7424          
    1-nitropentane
    C5H11NO2            (Mass of molecular ion:    117)
    

       Source Temperature: 220 °C
       Sample Temperature: 190 °C
       Reservoir, 75 eV
    

          26.0       1.7
          27.0      21.2
          28.0       3.8
          29.0      27.9
          30.0       5.6
          31.0       2.7
          38.0       1.2
          39.0      14.9
          40.0       2.9
          41.0      52.1
          42.0      19.3
          43.0     100.0
          44.0       3.7
          45.0       7.8
          46.0       1.8
          51.0       1.0
          53.0       2.5
          54.0       1.0
          55.0      19.4
          56.0       3.0
          57.0       1.9
          59.0       2.6
          60.0       1.8
          62.0       9.8
          67.0       1.0
          69.0      12.0
          70.0       6.5
          71.0      19.9
          72.0       1.3
          88.0       3.3
    

90 MHz in CDCl3

400 MHz in CDCl3


  • 1H NMR 89.56 MHz
    C5 H11 N O2 0.05 ml : 0.5 ml CDCl3
    1-nitropentane
    ChemicalStructure
        Assign.     Shift(ppm)
    A 4.379 B 2.01 C 1.5 to 1.24 D 0.92 400MHZ:HSP-41-351

         Hz     ppm     Int.
    

        399.38   4.460    482
        396.88   4.432     91
        392.44   4.382   1000
        389.13   4.345     96
        385.38   4.304    537
        194.50   2.172     54
        193.19   2.158     53
        187.31   2.092    190
        186.00   2.077    163
        185.19   2.068    155
        180.31   2.014    290
        178.06   1.989    195
        176.31   1.969    169
        175.25   1.957    172
        173.31   1.936    223
        169.00   1.888     83
        168.00   1.876     77
        166.25   1.857     85
        163.50   1.826     38
        162.00   1.809     32
        161.31   1.802     30
        141.25   1.578     34
        140.69   1.571     36
        140.06   1.564     35
        139.63   1.560     36
        138.94   1.552     39
        138.63   1.548     42
        137.63   1.537     46
        136.50   1.525     63
        131.69   1.471    191
        128.38   1.434    489
        125.13   1.398    570
        124.50   1.391    570
        120.94   1.351    703
        119.44   1.334    450
        117.38   1.311    381
        114.38   1.278    279
        108.75   1.215     74
        108.31   1.210     75
        107.13   1.197     62
        106.38   1.188     68
        104.38   1.166     56
        103.81   1.160     53
        103.38   1.155     51
        103.00   1.151     51
        102.38   1.144     47
        101.56   1.134     47
        101.00   1.128     46
        100.00   1.117     42
         99.06   1.107     42
         98.75   1.103     42
         97.94   1.094     40
         96.81   1.081     50
         96.50   1.078     50
         95.69   1.069     52
         89.06   0.995    391
         87.19   0.974    332
         82.69   0.924    830
         79.50   0.888    272
         77.44   0.865    262
         77.31   0.864    262
         76.88   0.859    261
         73.06   0.816     98
         69.31   0.774     32
    


  • 1H NMR 399.65 MHz
    C5 H11 N O2 0.05 ml : 0.5 ml CDCl3
    1-nitropentane
    ChemicalStructure
        Assign.     Shift(ppm)
    A 4.389 B 2.015 C 1.39 D 1.36 E 0.926

         Hz     ppm     Int.
    

       1767.46   4.423     40
       1761.23   4.407    511
       1754.15   4.390   1000
       1747.07   4.372    530
        819.46   2.051     68
        812.26   2.033    197
        809.81   2.027    141
        807.62   2.021    159
        805.05   2.015    282
        802.73   2.009    176
        800.66   2.004    145
        797.85   1.997    207
        790.65   1.979     68
        567.26   1.420     43
        560.67   1.403    109
        554.69   1.388    549
        551.27   1.380    509
        547.36   1.370    820
        544.31   1.362    391
        540.16   1.352    282
        537.96   1.347    115
        533.33   1.335     61
        529.17   1.325     34
        385.74   0.966     35
        385.13   0.964     35
        381.59   0.955     59
        376.95   0.944    355
        374.27   0.937    249
        370.00   0.926    902
        367.19   0.919    302
        364.99   0.914    219
        362.92   0.909    344
        356.32   0.892     39
    

in CDCl3



liquid film



4880 A,200 M,liquid