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Back ChemicalBook Home>CAS DataBase List>72707-66-5More Spectrum> 2-(BROMOMETHYL)ACRYLIC ACID(72707-66-5) IR1

2-(BROMOMETHYL)ACRYLIC ACID(72707-66-5) IR1

Molecular FormulaC4H5BrO2

Molecular Weight164.99

InChIInChI=1S/C4H5BrO2/c1-3(2-5)4(6)7/h1-2H2,(H,6,7)

InChIKey NOOYFQLPKUQDNE-UHFFFAOYSA-N

SmilesC(O)(=O)C(CBr)=C


  • Mass

    MS-NW-7115          
    2-(bromomethyl)acrylic acid
    C4H5BrO2            (Mass of molecular ion:    164)
    

       Source Temperature: 260 °C
       Sample Temperature: 190 °C
       Reservoir, 75 eV
    

          18.0       1.4
          26.0       1.8
          27.0       2.7
          28.0       2.2
          29.0      11.1
          31.0       3.2
          37.0       4.3
          38.0       8.0
          39.0      50.0
          40.0      16.9
          41.0      10.3
          44.0       2.1
          45.0      12.6
          53.0       1.0
          55.0       1.4
          57.0       9.5
          67.0       1.7
          68.0       1.2
          79.0       1.3
          80.0       1.7
          81.0       1.5
          82.0       1.6
          85.0     100.0
          86.0       5.1
          93.0       1.1
          95.0       1.0
         119.0       2.4
         121.0       2.4
         147.0       1.0
         164.0      18.3
         166.0      18.4
         167.0       1.0
    

90 MHz in CDCl3


  • 1H NMR 89.56 MHz
    C4 H5 Br O2 0.049 g : 0.5 ml CDCl3
    2-(bromomethyl)acrylic acid
    ChemicalStructure
        Assign.     Shift(ppm)
    A 12.1 B 6.505 C 6.108 D 4.179

         Hz     ppm     Int.
    

       1082.56  12.088    256
        585.58   6.539     73
        582.68   6.507    584
        579.94   6.476     27
        547.13   6.110    407
        544.14   6.076     26
        374.69   4.184   1000
        370.51   4.138     32
    

in CDCl3



KBr disc



nujol mull



2-(BROMOMETHYL)ACRYLIC ACID(72707-66-5) IR1 Atlas of Related Products

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