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64-04-0

苯乙胺(64-04-0)核磁图(13CNMR)

产品名称:苯乙胺

CAS:64-04-0

分子式:C8H11N

分子量: 121.18

InChI:InChI=1S/C8H11N/c9-7-6-8-4-2-1-3-5-8/h1-5H,6-7,9H2

InChIKey: BHHGXPLMPWCGHP-UHFFFAOYSA-N

Smiles:C1(CCN)=CC=CC=C1

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    Mass

    MS-NW-0761          
    phenethylamine
    C8H11N              (Mass of molecular ion:    121)
    

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

          28.0       2.3
          30.0     100.0
          31.0       1.3
          39.0       3.2
          50.0       1.3
          51.0       2.7
          63.0       2.1
          65.0       5.5
          77.0       2.4
          89.0       1.4
          91.0      15.1
          92.0       6.5
         103.0       1.6
         120.0       1.0
         121.0       6.0
    

90 MHz in CDCl3

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    1H NMR 89.56 MHz
    C8 H11 N 0.04 ml : 0.5 ml CDCl3
    phenethylamine
    ChemicalStructure
        Assign.     Shift(ppm)
    A 7.42 to 7.04 B 2.929 C 2.733 D 1.16

         Hz     ppm     Int.
    

        654.88   7.313     75
        652.38   7.285    219
        651.31   7.273    135
        650.50   7.264    123
        647.63   7.232   1000
        645.81   7.211    838
        642.81   7.178    191
        641.31   7.161    104
        640.56   7.153    124
        639.94   7.146    115
        639.31   7.139     80
        638.63   7.131     81
        638.25   7.127     87
        637.88   7.123     89
        272.44   3.042    110
        269.81   3.013    131
        267.00   2.982    115
        263.38   2.941    561
        258.63   2.888    386
        257.50   2.876    429
        249.63   2.788    319
        248.69   2.777    297
        243.75   2.722    359
        240.19   2.682    106
        237.38   2.651     90
        234.81   2.622     82
        103.88   1.160    859
    

in CDCl3

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liquid film

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