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16728-59-9

3-N-丙氧基丙胺(16728-59-9)核磁图(13CNMR)

产品名称:3-N-丙氧基丙胺

CAS:16728-59-9

分子式:C6H15NO

分子量: 117.19

InChI:InChI=1S/C6H15NO/c1-2-5-8-6-3-4-7/h2-7H2,1H3

InChIKey: UTOXFQVLOTVLSD-UHFFFAOYSA-N

Smiles:C(N)CCOCCC

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    Mass

    MS-IW-2205          
    3-propoxypropylamine
    C6H15NO             (Mass of molecular ion:    117)
    

       Source Temperature: 230 °C
       Sample Temperature: 160 °C
       Reservoir, 75 eV
    

          15.0       1.8
          18.0       6.0
          26.0       1.2
          27.0      13.2
          28.0      15.3
          29.0       9.2
          30.0     100.0
          31.0      17.6
          32.0       1.4
          39.0       6.4
          40.0       1.3
          41.0      28.1
          42.0      11.2
          43.0      45.4
          44.0      20.6
          45.0       7.2
          46.0       1.0
          54.0       1.0
          55.0       1.4
          56.0      54.6
          57.0      65.3
          58.0      53.8
          59.0      20.4
          60.0       5.9
          72.0       2.1
          73.0       1.5
          74.0      28.2
          75.0       2.6
         100.0      26.0
         101.0       1.8
    

400 MHz in CDCl3

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    1H NMR 399.65 MHz
    C6 H15 N O 0.05 ml : 0.5 ml CDCl3
    3-propoxypropylamine
    ChemicalStructure
        Assign.     Shift(ppm)
    A 3.489 B 3.366 C 2.790 D 2.14 E 1.720 F 1.581 G 0.915

         Hz     ppm     Int.
    

       1400.88   3.506    388
       1397.09   3.496     57
       1394.65   3.490    669
       1388.43   3.475    390
       1352.17   3.384    426
       1345.46   3.367    740
       1338.75   3.350    429
       1122.07   2.808    182
       1115.23   2.791    336
       1108.40   2.774    188
        854.25   2.138    244
        700.07   1.752    120
        693.97   1.737    288
        693.36   1.735    273
        687.13   1.720    430
        680.91   1.704    267
        680.42   1.703    250
        674.19   1.687    107
        650.15   1.627     58
        642.70   1.609    189
        635.99   1.592    353
        628.66   1.574    356
        621.83   1.556    201
        614.50   1.538     67
        373.05   0.934    631
        369.75   0.926     35
        365.72   0.916   1000
        361.08   0.904     36
        358.15   0.897    556
    

in CDCl3

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liquid film

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