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2937-50-0

氯甲酸烯丙酯(2937-50-0)Raman光谱

产品名称:氯甲酸烯丙酯

CAS:2937-50-0

分子式:C4H5ClO2

分子量: 120.53

InChI:InChI=1S/C4H5ClO2/c1-2-3-7-4(5)6/h2H,1,3H2

InChIKey: CAEWJEXPFKNBQL-UHFFFAOYSA-N

Smiles:C(Cl)(OCC=C)=O

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    Mass

    MS-IW-4899          
    allyl chloroformate
    C4H5ClO2            (Mass of molecular ion:    120)
    

       Source Temperature: 220 °C
       Sample Temperature: 150 °C
       Reservoir, 75 eV
    

          14.0       1.0
          15.0       3.3
          25.0       1.4
          26.0       8.9
          27.0      22.2
          28.0      15.6
          29.0      23.5
          30.0       1.0
          31.0       2.4
          35.0       4.1
          36.0       5.9
          37.0       5.8
          38.0       9.9
          39.0      73.0
          40.0      52.9
          41.0     100.0
          42.0       7.1
          42.5       1.6
          43.0       3.2
          44.0      31.8
          45.0       1.7
          49.0       1.0
          55.0       5.6
          56.0       5.6
          57.0      32.5
          58.0       1.4
          63.0      95.3
          64.0       2.8
          65.0      34.1
          75.0       1.6
          76.0      19.9
          77.0       1.3
          78.0       9.6
          80.0       1.1
          81.0       2.0
          84.0       2.7
          85.0       5.2
          91.0       1.5
          92.0       1.9
          93.0       1.6
         120.0       3.1
         122.0       1.2
    

90 MHz in CDCl3

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    1H NMR 89.56 MHz
    C4 H5 Cl O2 0.04 ml : 0.5 ml CDCl3
    allyl chloroformate
    ChemicalStructure
        Assign.     Shift(ppm)
    A 5.93 B 5.43 C 5.37 D 4.78

         Hz     ppm     Int.
    

        554.25   6.189     98
        548.19   6.121    148
        544.81   6.084     63
        544.06   6.075     77
        542.50   6.058    111
        539.13   6.020     84
        538.06   6.008    131
        537.31   6.000    106
        536.56   5.992    106
        533.81   5.961     56
        532.44   5.946     99
        531.31   5.933    160
        530.25   5.921    147
        527.19   5.887    210
        525.69   5.870    132
        524.31   5.855    109
        521.56   5.824    290
        521.13   5.819    372
        515.63   5.758    307
        495.88   5.537    174
        494.63   5.523    397
        494.13   5.518    382
        493.00   5.505    683
        491.75   5.491    290
        487.75   5.447    300
        486.81   5.436    592
        485.81   5.425    403
        485.19   5.418    339
        484.25   5.407    152
        479.06   5.350    229
        477.69   5.334    532
        476.38   5.320    373
        475.94   5.315    284
        475.06   5.305    470
        474.19   5.295    291
        431.69   4.821    733
        430.81   4.811   1000
        429.56   4.797    703
        427.88   4.778     53
        425.81   4.755    522
        424.75   4.743    865
        423.69   4.731    556
    

in CDCl3

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liquid film

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