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返回ChemicalBook首页>CAS数据库列表>54897-62-0更多图谱> N-乙基-N-(4-羟丁基)亚硝胺(54897-62-0)核磁图(1HNMR)

54897-62-0

N-乙基-N-(4-羟丁基)亚硝胺(54897-62-0)核磁图(1HNMR)

分子式:C6H14N2O2

分子量: 146.19

InChI:InChI=1S/C6H14N2O2/c1-2-8(7-10)5-3-4-6-9/h9H,2-6H2,1H3

InChIKey: SAWPRHGGVOPPSR-UHFFFAOYSA-N

Smiles:C(O)CCCN(CC)N=O

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    Mass

    MS-NW-1415          
    4-(N-ethyl-N-nitrosoamino)-1-butanol
    C6H14N2O2           (Mass of molecular ion:    146)
    

       Source Temperature: 270 °C
       Sample Temperature: 180 °C
       Reservoir, 75 eV
    

          14.0       1.0
          15.0       9.5
          17.0       3.5
          18.0      15.3
          19.0       3.2
          26.0       4.6
          27.0      39.6
          28.0      62.2
          29.0      92.4
          30.0      46.0
          31.0      76.7
          32.0       1.4
          38.0       1.2
          39.0      13.2
          40.0       3.4
          41.0      43.2
          42.0      99.4
          43.0      63.7
          44.0      57.2
          45.0       6.4
          46.0       8.6
          47.0       1.5
          52.0       1.0
          53.0       4.2
          54.0       6.4
          55.0      67.2
          56.0     100.0
          57.0      91.1
          58.0      75.9
          59.0       6.8
          67.0       1.0
          68.0       6.6
          69.0       4.0
          70.0      16.1
          71.0      31.6
          72.0      15.7
          73.0       9.1
          74.0       5.4
          75.0       8.1
          80.0       1.0
          82.0       3.3
          84.0       4.9
          85.0       1.7
          86.0       1.2
          87.0      49.7
          88.0      12.1
          96.0       1.3
          97.0       2.1
          98.0      24.3
          99.0       3.4
         100.0      12.8
         101.0       3.5
         102.0       1.0
         114.0       1.9
         115.0       8.5
         116.0       3.5
         128.0       1.4
         129.0      63.8
         130.0       4.8
         146.0       1.1
    

90 MHz in CDCl3

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    1H NMR 89.56 MHz
    C6 H14 N2 O2 0.04 ml : 0.5 ml CDCl3
    4-(N-ethyl-N-nitrosoamino)-1-butanol
    ChemicalStructure
        Assign.     Shift(ppm)
    A 4.15 B 4.12 C 3.69 D 3.64 E 3.61 F 3.60 G 2.56 J 2.26 to 1.31 K 1.413 L 1.107

         Hz     ppm     Int.
    

        376.56   4.205    151
        375.25   4.190    326
        369.63   4.128    277
        368.00   4.109    338
        362.56   4.049    175
        337.00   3.763    189
        330.75   3.694    402
        327.06   3.652    386
        325.88   3.639    348
        324.81   3.627    278
        322.50   3.601    177
        319.88   3.572    455
        229.38   2.562   1000
        145.13   1.621    161
        142.81   1.595    238
        141.69   1.583    147
        141.25   1.578    161
        139.75   1.561    185
        136.06   1.520    238
        133.31   1.489    358
        126.06   1.408    673
        118.81   1.327    267
        106.06   1.185    343
         98.88   1.105    746
         91.75   1.025    295
    

liquid film

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