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1119-49-9

N-丁基乙酰胺(1119-49-9)核磁图(1HNMR)

产品名称:N-丁基乙酰胺

CAS:1119-49-9

分子式:C6H13NO

分子量: 115.17

InChI:InChI=1S/C6H13NO/c1-3-4-5-7-6(2)8/h3-5H2,1-2H3,(H,7,8)

InChIKey: GYLDXXLJMRTVSS-UHFFFAOYSA-N

Smiles:C(NCCCC)(=O)C

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    Mass

    MS-IW-3841          
    n-butylacetamide
    C6H13NO             (Mass of molecular ion:    115)
    

       Source Temperature: 220 °C
       Sample Temperature: 150 °C
       Reservoir, 75 eV
    

          15.0       6.4
          18.0       3.1
          26.0       1.4
          27.0      12.9
          28.0      26.4
          29.0      13.9
          30.0     100.0
          31.0       7.5
          32.0       4.0
          38.0       1.1
          39.0      10.4
          40.0       2.3
          41.0      22.0
          42.0      13.5
          43.0      94.2
          44.0      60.9
          45.0       6.2
          53.0       1.4
          54.0       1.5
          55.0       5.3
          56.0       9.8
          57.0       8.9
          58.0      12.7
          59.0       2.4
          60.0      31.8
          61.0       1.0
          70.0       1.0
          72.0      98.8
          73.0      79.2
          74.0       3.5
          86.0      33.5
          87.0       4.2
         100.0      23.4
         101.0       1.4
         115.0      50.8
         116.0       4.5
    

400 MHz in CDCl3

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    1H NMR 399.65 MHz
    C6 H13 N O 0.05 ml : 0.5 ml CDCl3
    N-butylacetamide
    ChemicalStructure
        Assign.     Shift(ppm)
    A 7.05 B 3.214 C 1.983 D 1.489 E 1.352 F 0.919

         Hz     ppm     Int.
    

       2815.67   7.046     36
       1294.68   3.240    113
       1288.82   3.225    157
       1287.48   3.222    195
       1281.74   3.208    197
       1280.27   3.204    158
       1274.54   3.190    128
        792.60   1.984   1000
        612.06   1.532     39
        611.33   1.530     37
        604.98   1.514    107
        602.05   1.507     57
        597.05   1.494    165
        594.48   1.488     97
        590.45   1.478    125
        589.72   1.476    127
        587.52   1.471     69
        582.52   1.458     71
        582.03   1.457     70
        558.35   1.398     45
        551.15   1.380    115
        546.02   1.367     56
        543.95   1.362    140
        543.33   1.360    144
        542.60   1.358    130
        538.57   1.348     61
        535.28   1.340    151
        531.37   1.330     33
        528.32   1.322     92
        521.36   1.305     34
        374.51   0.938    414
        367.19   0.919    726
        362.55   0.908     43
        359.86   0.901    353
    

in CDCl3

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liquid film

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