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540-54-5

1-氯丙烷(540-54-5)Raman光谱

产品名称:1-氯丙烷

CAS:540-54-5

分子式:C3H7Cl

分子量: 78.54

InChI:InChI=1S/C3H7Cl/c1-2-3-4/h2-3H2,1H3

InChIKey: SNMVRZFUUCLYTO-UHFFFAOYSA-N

Smiles:C(Cl)CC

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    Mass

    MS-NW-0944          
    1-chloropropane
    C3H7Cl              (Mass of molecular ion:     78)
    

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

          15.0       1.3
          18.0       1.3
          26.0       3.9
          27.0      31.9
          28.0      12.9
          29.0      40.6
          36.0       1.2
          37.0       2.3
          38.0       3.1
          39.0      11.4
          40.0       3.1
          41.0      23.2
          42.0     100.0
          43.0      13.7
          49.0       4.2
          51.0       1.3
          63.0       4.7
          65.0       1.4
          78.0       2.7
    

parameter in benzene

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    1H NMR 300 MHz
    C3 H7 Cl 90 vol% in benzene
    1-chloropropane
    ChemicalStructure
        Parameter     ppm  Hz
    D(A) 3.302 D(B) 1.613 D(C) 0.855 J(A,B) 6.60 J(A,C) -0.06 J(B,C) 7.35 SCHRUMPF,G. J.MAGN.RESON. 6, 243 (1972)

         Hz     ppm     Int.
    

        997.25   3.324    353
        990.66   3.302    721
        984.06   3.280    371
        501.66   1.672     40
        494.30   1.648    138
        487.61   1.625    274
        480.36   1.601    282
        473.64   1.579    149
        466.46   1.555     45
        263.73   0.879    509
        256.40   0.855   1000
        249.05   0.830    442
    

in CDCl3

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liquid film

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4880 A,200 M,liquid

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