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57297-29-7

环丙甲脒盐酸盐(57297-29-7)红外图谱(IR1)

分子式:C4H9ClN2

分子量: 120.58

InChI:InChI=1S/C4H8N2.ClH/c5-4(6)3-1-2-3;/h3H,1-2H2,(H3,5,6);1H

InChIKey: JRYOZJIRAVZGMV-UHFFFAOYSA-N

Smiles:C1(C(N)=N)CC1.[H]Cl

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    Mass

    MS-IW-2759          
    cyclopropanecarboxamidine hydrochloride
    C4H8N2 HCl          (Mass of molecular ion:     84)
    

       Source Temperature: 160 °C
       Sample Temperature: 170 °C
       Direct, 75 eV
    

          15.0       2.1
          17.0       1.8
          18.0      21.8
          26.0       3.0
          27.0       7.9
          28.0      24.3
          29.0       5.2
          30.0       9.7
          31.0       1.2
          35.0      12.3
          36.0      85.9
          37.0       6.4
          38.0      35.6
          39.0      42.7
          40.0       9.7
          41.0      69.7
          42.0      18.2
          43.0      94.3
          44.0      13.0
          51.0       1.6
          52.0       5.7
          53.0       1.5
          54.0      13.0
          55.0       4.5
          56.0      21.5
          57.0       2.6
          58.0       4.4
          66.0      12.4
          67.0      96.5
          68.0      38.0
          69.0       6.0
          82.0       2.3
          83.0      74.6
          84.0     100.0
          85.0       6.4
    

400 MHz in DMSO-d6

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    1H NMR 399.65 MHz
    C4 H8 N2 0.038 g : 0.5 ml DMSO-d6
    cyclopropanecarboxamidine hydrochloride
    ChemicalStructure
        Assign.     Shift(ppm)
    A *1 8.92 B *1 8.74 C 1.882 D *2 1.15 E *2 1.11

         Hz     ppm     Int.
    

       3564.09   8.919    789
       3494.75   8.745    792
        766.24   1.918     75
        760.99   1.905    166
        758.06   1.897    187
        753.17   1.885    334
        748.05   1.872    213
        744.75   1.864    198
        739.62   1.851     98
        472.17   1.182    155
        466.06   1.167    551
        463.13   1.159    830
        460.82   1.154   1000
        458.13   1.147    777
        455.20   1.139    637
        452.03   1.132    556
        450.93   1.129    524
        449.10   1.124    812
        446.41   1.118    535
        443.97   1.111    744
        440.80   1.103    796
        437.99   1.096    584
        432.13   1.082    217
    

in DMSO-d6

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KBr disc

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nujol mull

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