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20845-34-5

1-甲基-2-哌啶甲醇(20845-34-5)Raman光谱

分子式:C7H15NO

分子量: 129.2

InChI:InChI=1S/C7H15NO/c1-8-5-3-2-4-7(8)6-9/h7,9H,2-6H2,1H3

InChIKey: HXXJMMLIEYAFOZ-UHFFFAOYSA-N

Smiles:N1(C)CCCCC1CO

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    Mass

    MS-NW-5624          
    1-methyl-2-piperidinemethanol
    C7H15NO             (Mass of molecular ion:    129)
    

       Source Temperature: 280 °C
       Sample Temperature: 190 °C
       Reservoir, 75 eV
    

          15.0       2.3
          18.0       1.7
          27.0       3.3
          28.0       2.8
          29.0       1.9
          30.0       1.9
          31.0       1.4
          39.0       3.2
          41.0       5.5
          42.0      19.0
          43.0       2.8
          44.0       9.1
          53.0       1.1
          54.0       1.3
          55.0       4.5
          56.0       2.3
          57.0       2.9
          67.0       1.7
          68.0       2.9
          69.0       1.1
          70.0      21.7
          71.0       1.3
          82.0       3.5
          83.0       1.4
          84.0       2.1
          94.0       1.0
          96.0       5.3
          97.0       1.9
          98.0     100.0
          99.0       7.1
         110.0       2.5
         111.0       2.7
    

400 MHz in CDCl3

90 MHz in CDCl3

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    1H NMR 399.65 MHz
    C7 H15 N O 0.05 ml : 0.5 ml CDCl3
    1-methyl-2-piperidinemethanol
    ChemicalStructure
        Assign.     Shift(ppm)
    A *1 3.761 B 3.52 C *1 3.485 D 2.862 E 2.296 F 2.113 G 1.942 J 1.754 K *2 1.65 L *2 1.61 M 1.55 N 1.52 P 1.276 ASSINED BY COSY. J(A,C)=-11.0HZ. J(A,G)=4.4HZ. J(C,G)=2.9HZ. 90MHZ : HSP-03-583

         Hz     ppm     Int.
    

       1511.23   3.782     70
       1506.84   3.771     72
       1500.24   3.754     84
       1495.85   3.743     82
       1406.49   3.520    116
       1398.93   3.501     89
       1396.00   3.494     83
       1387.82   3.473     66
       1385.01   3.466     66
       1151.73   2.882     33
       1148.44   2.874     51
       1146.48   2.869     35
       1144.90   2.865     32
       1141.72   2.857     31
       1140.14   2.853     36
       1137.57   2.847     54
       1133.54   2.837     30
        917.60   2.297   1000
        858.28   2.148     51
        854.98   2.140     44
        846.68   2.119    102
        843.38   2.111     94
        835.08   2.090     54
        831.79   2.082     52
        783.94   1.962     41
        779.91   1.952     43
        776.37   1.943     39
        773.07   1.935     48
        769.04   1.925     48
        708.86   1.774     37
        707.89   1.772     40
        705.57   1.766     32
        704.10   1.762     33
        699.83   1.752     30
        698.61   1.749     31
        696.17   1.742     42
        695.07   1.740     44
        692.75   1.734     35
        666.38   1.668     30
        663.82   1.662     32
        661.99   1.657     32
        657.96   1.647     30
        656.25   1.643     36
        654.54   1.638     46
        652.95   1.634     64
        651.98   1.632     59
        650.39   1.628     66
        648.80   1.624     70
        647.34   1.620     49
        645.63   1.616     50
        642.82   1.609     33
        639.89   1.602     62
        637.33   1.595     53
        635.86   1.592     83
        634.03   1.587     67
        632.69   1.584     87
        631.10   1.580     70
        628.91   1.574    105
        627.69   1.571     96
        625.00   1.564     69
        623.54   1.561     63
        621.09   1.555     52
        616.94   1.544     87
        613.28   1.535     62
        612.55   1.533     64
        610.23   1.527     39
        609.13   1.525     38
        608.15   1.522     31
        605.22   1.515     48
        604.00   1.512     48
        601.44   1.505     33
        599.24   1.500     30
        526.73   1.318     30
        518.55   1.298     38
        514.28   1.287     61
        509.89   1.276     30
        506.23   1.267     32
        501.95   1.256     51
    

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    1H NMR 89.56 MHz
    C7 H15 N O 0.04 ml : 0.5 ml CDCl3
    1-methyl-2-piperidinemethanol
    ChemicalStructure
        Assign.     Shift(ppm)
    A *1 3.797 B *1 3.444 C 2.93 D 2.91 E 2.290 F 2.13 G 1.95 J 1.77 K 1.70 to 1.46 L 1.30 400MHZ : HSP-40-449

         Hz     ppm     Int.
    

        349.13   3.899     32
        345.25   3.855     33
        338.25   3.777     59
        334.25   3.733     61
        313.75   3.504     48
        311.31   3.476     51
        262.38   2.930    108
        252.69   2.822     30
        205.38   2.294   1000
        177.63   1.984     35
        150.31   1.679     60
        149.56   1.670     59
        148.81   1.662     55
        144.88   1.618     91
        142.25   1.589     85
        141.44   1.580     74
        140.44   1.569     82
        139.38   1.557     76
        136.56   1.525     57
        134.25   1.499     38
        132.13   1.476     32
        129.13   1.442     32
        129.00   1.441     32
    

in CDCl3

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liquid film

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