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372-29-2

3-氨基-4,4,4-三氟巴豆酸乙酯(372-29-2)红外图谱(IR1)

分子式:C6H8F3NO2

分子量: 183.13

InChI:InChI=1S/C6H8F3NO2/c1-2-12-5(11)3-4(10)6(7,8)9/h3H,2,10H2,1H3

InChIKey: NXVKRKUGIINGHD-UHFFFAOYSA-N

Smiles:C(OCC)(=O)C=C(N)C(F)(F)F

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    Mass

    MS-KW-0223          
    ethyl 3-amino-4,4,4-trifluorocrotonate
    C6H8F3NO2           (Mass of molecular ion:    183)
    

       Source Temperature: 240 °C
       Sample Temperature: 150 °C
       Reservoir, 75 eV
    

          15.0       1.7
          17.0       2.9
          18.0       1.1
          20.0       1.1
          26.0       2.0
          27.0       8.6
          28.0       7.7
          29.0      14.8
          31.0       3.9
          39.0       1.3
          40.0       4.9
          41.0       7.5
          42.0       3.7
          43.0      11.7
          44.0       3.8
          45.0       4.0
          46.0       3.4
          47.0       1.1
          51.0       1.0
          60.0       2.0
          67.0       1.2
          68.0      30.9
          69.0       7.3
          70.0       1.9
          86.0       2.3
          88.0       2.9
          90.0       6.3
          91.0       8.8
          96.0      11.9
         111.0      38.6
         112.0       2.1
         116.0       1.5
         119.0       1.2
         136.0       5.4
         137.0      18.1
         138.0     100.0
         139.0      13.3
         155.0      13.3
         183.0      25.2
         184.0       2.2
    

400 MHz in CDCl3

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in CDCl3

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Liquid film

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