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返回ChemicalBook首页>CAS数据库列表>821-48-7更多图谱> 双(2-氯乙基)胺盐酸盐(821-48-7)质谱(MS)

821-48-7

双(2-氯乙基)胺盐酸盐(821-48-7)质谱(MS)

分子式:C4H10Cl3N

分子量: 178.49

InChI:InChI=1S/C4H9Cl2N.ClH/c5-1-3-7-4-2-6;/h7H,1-4H2;1H

InChIKey: YMDZDFSUDFLGMX-UHFFFAOYSA-N

Smiles:N(CCCl)CCCl.Cl

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    Mass

    MS-NW-7393          
    bis(2-chloroethyl)amine hydrochloride
    C4H9Cl2N HCl        (Mass of molecular ion:    141)
    

       Source Temperature: 150 °C
       Sample Temperature: 100 °C
       Direct, 75 eV
    

          15.0       1.6
          18.0       1.7
          26.0       2.1
          27.0      17.0
          28.0      12.3
          29.0       3.1
          30.0      14.2
          35.0       4.0
          36.0      18.0
          37.0       1.5
          38.0       6.3
          40.0       1.2
          41.0       3.4
          42.0       7.2
          43.0       3.0
          44.0       5.3
          49.0       3.0
          51.0       1.0
          56.0      15.9
          57.0       3.5
          63.0      27.2
          64.0       2.2
          65.0       8.6
          70.0       1.9
          78.0       2.2
          92.0     100.0
          93.0       4.0
          94.0      31.3
          95.0       1.3
         106.0       3.7
         108.0       1.0
         140.0       1.0
         141.0       3.2
         143.0       2.0
    

400 MHz in DMSO-d6

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    1H NMR 399.65 MHz
    C4 H9 Cl2 N 0.039 g : 0.5 ml DMSO-d6
    bis(2-chloroethyl)amine hydrochloride
    ChemicalStructure
        Assign.     Shift(ppm)
    A 9.79 B 3.974 C 3.371

         Hz     ppm     Int.
    

       3914.49   9.795     43
       1594.85   3.991    443
       1588.29   3.975   1000
       1581.88   3.959    471
       1369.48   3.427     21
       1369.17   3.426     21
       1367.19   3.421     22
       1366.42   3.420     22
       1365.81   3.418     23
       1360.63   3.405     25
       1353.61   3.387    432
       1347.20   3.371    830
       1340.64   3.355    377
    

in DMSO-d6

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KBr disc

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nujol mull

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