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Back ChemicalBook Home>CAS DataBase List>110-56-5More Spectrum> 1,4-Dichlorobutane(110-56-5) IR2

110-56-5

1,4-Dichlorobutane(110-56-5) IR2

Product Name1,4-Dichlorobutane

CAS110-56-5

Molecular FormulaC4H8Cl2

Molecular Weight127.01

InChIInChI=1S/C4H8Cl2/c5-3-1-2-4-6/h1-4H2

InChIKey KJDRSWPQXHESDQ-UHFFFAOYSA-N

SmilesC(Cl)CCCCl

  • 1,4-Dichlorobutane(110-56-5) IR2
    Mass

    MS-NW-0819          
    1,4-dichlorobutane
    C4H8Cl2             (Mass of molecular ion:    126)
    

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

          26.0       2.3
          27.0      14.0
          28.0       4.3
          29.0       5.1
          36.0       1.0
          39.0       9.5
          41.0      25.8
          42.0       1.5
          49.0       6.8
          50.0       1.2
          51.0       2.1
          53.0       4.7
          54.0      13.0
          55.0     100.0
          56.0       4.7
          61.0       1.3
          62.0      15.4
          63.0       6.4
          64.0       5.0
          65.0       1.9
          75.0       6.7
          77.0       2.6
          90.0      29.8
          91.0       3.3
          92.0      10.0
    

400 MHz in CDCl3

  • 1,4-Dichlorobutane(110-56-5) IR2

    1H NMR 399.65 MHz
    C4 H8 Cl2 0.05 ml : 0.5 ml CDCl3
    1,4-dichlorobutane
    ChemicalStructure
        Assign.     Shift(ppm)
    A 3.584 B 1.944

         Hz     ppm     Int.
    

       1438.60   3.600    486
       1437.38   3.597    374
       1436.16   3.594    344
       1434.81   3.591    442
       1433.59   3.588    486
       1432.37   3.585    904
       1431.15   3.582    474
       1430.05   3.579    427
       1428.59   3.575    330
       1427.37   3.572    359
       1426.15   3.569    479
        783.33   1.961    451
        780.52   1.954    469
        778.32   1.948    376
        777.22   1.945   1000
        776.00   1.942    373
        773.68   1.936    458
        770.87   1.929    426
    

in CDCl3

  • 1,4-Dichlorobutane(110-56-5) IR2

CCl4 solution

  • 1,4-Dichlorobutane(110-56-5) IR2

liquid film

  • 1,4-Dichlorobutane(110-56-5) IR2

4880 A,200 M,liquid

  • 1,4-Dichlorobutane(110-56-5) IR2

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