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109-61-5

氯甲酸丙酯(109-61-5)質譜(MS)

產(chǎn)品名稱:氯甲酸丙酯

CAS:109-61-5

分子式:C4H7ClO2

分子量: 122.55

InChI:InChI=1S/C4H7ClO2/c1-2-3-7-4(5)6/h2-3H2,1H3

InChIKey: QQKDTTWZXHEGAQ-UHFFFAOYSA-N

Smiles:C(Cl)(OCCC)=O

  • 圖譜
    Mass 

    MS-NW-0979          
propyl chloroformate
C4H7ClO2            (Mass of molecular ion:    122)


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


          15.0       2.1
      26.0       3.6
      27.0      26.8
      28.0       6.1
      29.0      11.7
      30.0       2.2
      31.0       6.5
      35.0       1.5
      36.0       2.5
      37.0       1.0
      38.0       1.7
      39.0       9.0
      40.0       3.6
      41.0      32.1
      42.0     100.0
      43.0      71.8
      44.0       7.2
      57.0       2.8
      59.0       5.6
      63.0      48.6
      65.0      15.7
      81.0       1.0
      93.0      15.3
      95.0       5.1

90 MHz in CDCl3

  • 圖譜

    1H NMR 89.56 MHz
    C4 H7 Cl O2 0.02 ml : 0.5 ml CDCl3
    propyl chloroformate
    ChemicalStructure 
        Assign.     Shift(ppm)
    
      A             4.284
      B             1.759
      C             0.998
  

         Hz     ppm     Int.


        390.31   4.359    436
    383.75   4.285    901
    377.13   4.211    480
    162.19   1.811    221
    155.63   1.738    176
    154.63   1.727    265
    147.81   1.651    190
     96.50   1.078    287
     95.88   1.071    480
     88.94   0.994   1000
     88.25   0.986    526
     81.81   0.914    187
     81.19   0.907    287
     80.25   0.897    158

in CDCl3

  • 圖譜

liquid film

  • 圖譜

4880 A,200 M,liquid

  • 圖譜

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