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Back ChemicalBook Home>CAS DataBase List>41145-84-0More Spectrum> 2-BROMOPROPIONIC ACID N-BUTYL ESTER(41145-84-0) 1H NMR

41145-84-0

2-BROMOPROPIONIC ACID N-BUTYL ESTER(41145-84-0) 1H NMR

Molecular FormulaC7H13BrO2

Molecular Weight209.08

InChIInChI=1S/C7H13BrO2/c1-3-4-5-10-7(9)6(2)8/h6H,3-5H2,1-2H3

InChIKey INMAEXGIVZJYIJ-UHFFFAOYSA-N

SmilesC(OCCCC)(=O)C(Br)C

  • 2-BROMOPROPIONIC ACID N-BUTYL ESTER(41145-84-0) <sup>1</sup>H NMR
    Mass

    MS-NW-0951          
    butyl 2-bromopropionate
    C7H13BrO2           (Mass of molecular ion:    208)
    

       Source Temperature: 280 °C
       Sample Temperature: 150 °C
       Reservoir, 75 eV
    

          18.0       1.3
          26.0       4.2
          27.0      29.7
          28.0      17.3
          29.0      54.2
          30.0       1.3
          31.0       2.8
          39.0       6.8
          40.0       1.3
          41.0      59.7
          42.0       3.3
          43.0       6.3
          45.0       1.2
          55.0      10.2
          56.0     100.0
          57.0      92.9
          58.0       4.2
          71.0       1.0
          73.0       2.2
          74.0       1.7
         107.0      12.9
         109.0      12.5
         135.0       9.0
         137.0       8.7
         153.0       6.0
         155.0       6.2
    

90 MHz in CDCl3

  • 2-BROMOPROPIONIC ACID N-BUTYL ESTER(41145-84-0) <sup>1</sup>H NMR

    1H NMR 89.56 MHz
    C7 H13 Br O2 0.04 ml : 0.5 ml CDCl3
    butyl 2-bromopropionate
    ChemicalStructure
        Assign.     Shift(ppm)
    A 4.353 B 4.174 C 1.824 D 1.19 to 1.95 E 0.954

         Hz     ppm     Int.
    

        401.56   4.484     75
        394.56   4.406    209
        387.63   4.329    222
        380.75   4.252    185
        374.06   4.177    310
        367.56   4.105    208
        166.69   1.862   1000
        159.75   1.784    944
        157.56   1.760     86
        156.00   1.742     82
        153.75   1.717     83
        149.13   1.666    120
        148.19   1.655     89
        147.13   1.643     91
        142.50   1.592    137
        140.25   1.566     95
        136.31   1.522    122
        130.19   1.454     92
        128.50   1.435     96
        124.56   1.391     75
        121.63   1.359     85
        115.31   1.288     76
         91.31   1.020    226
         84.88   0.948    443
         83.44   0.932    151
         78.50   0.877     75
         77.50   0.866     90
    

in CDCl3

  • 2-BROMOPROPIONIC ACID N-BUTYL ESTER(41145-84-0) <sup>1</sup>H NMR

liquid film

  • 2-BROMOPROPIONIC ACID N-BUTYL ESTER(41145-84-0) <sup>1</sup>H NMR

4880 A,200 M,liquid

  • 2-BROMOPROPIONIC ACID N-BUTYL ESTER(41145-84-0) <sup>1</sup>H NMR

2-BROMOPROPIONIC ACID N-BUTYL ESTER(41145-84-0) 1H NMR Atlas of Related Products

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