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503-29-7

氮杂环丁烷(503-29-7)Raman光谱

产品名称:氮杂环丁烷

CAS:503-29-7

分子式:C3H7N

分子量: 57.09

InChI:InChI=1S/C3H7N/c1-2-4-3-1/h4H,1-3H2

InChIKey: HONIICLYMWZJFZ-UHFFFAOYSA-N

Smiles:N1CCC1

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    Mass

    MS-IW-9210          
    azetidine
    C3H7N               (Mass of molecular ion:     57)
    

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

          15.0       1.6
          18.0       1.8
          26.0       8.1
          26.5       2.0
          27.0      16.3
          28.0     100.0
          29.0      78.9
          30.0      52.9
          31.0       2.4
          38.0       1.0
          39.0       1.8
          40.0       1.7
          41.0       3.2
          42.0       7.4
          44.0       1.0
          51.0       1.5
          52.0       2.4
          54.0       3.6
          55.0       1.5
          56.0      35.0
          57.0      80.2
          58.0       3.7
    

400 MHz in CDCl3

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    1H NMR 399.65 MHz
    C3 H7 N 0.05 ml : 0.5 ml CDCl3
    azetidine
    ChemicalStructure
        Assign.     Shift(ppm)
    A 3.628 B 2.327 C 2.08

         Hz     ppm     Int.
    

       1457.52   3.647    797
       1450.20   3.629   1000
       1445.56   3.618     89
       1442.75   3.611    781
        945.07   2.365    159
        941.89   2.357     28
        940.92   2.355     36
        937.62   2.347    421
        935.18   2.340     48
        933.72   2.337     50
        930.30   2.328    526
        926.76   2.319     46
        925.66   2.317     44
        922.85   2.310    360
        919.68   2.302     30
        918.58   2.299     23
        915.53   2.291    146
        829.35   2.076    238
    

in CDCl3

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liquid film

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