1,4-Dibromopentane(626-87-9) ¹³C NMR

Product Name1,4-Dibromopentane

CAS 626-87-9

Molecular FormulaC5H10Br2

Molecular Weight229.94

InChIInChI=1S/C5H10Br2/c1-5(7)3-2-4-6/h5H,2-4H2,1H3

InChIKey CNBFRBXEGGRSPL-UHFFFAOYSA-N

SmilesC(Br)CCC(Br)C

Request For Quotation

Mass

MS-NW-1055          
1,4-dibromopentane
C5H10Br2            (Mass of molecular ion:    228)

   Source Temperature: 240 °C
   Sample Temperature: 170 °C
   Reservoir, 75 eV

      18.0       1.4
      26.0       1.8
      27.0      16.8
      29.0       6.2
      38.0       1.5
      39.0      12.8
      40.0       2.4
      41.0      62.1
      42.0       8.1
      43.0      11.8
      53.0       4.0
      55.0       5.1
      67.0       2.4
      68.0       1.1
      69.0     100.0
      70.0       5.8
     107.0       6.4
     109.0       6.0
     121.0       1.0
     149.0      30.9
     150.0       2.5
     151.0      29.3
     152.0       1.7

90 MHz in CDCl3

¹H NMR	89.56 MHz
C₅ H₁₀ Br₂	0.02 ml : 0.5 ml CDCl₃
1,4-dibromopentane

    Assign.     Shift(ppm)

      A             4.15
      B             3.44
      C          2.22 to 1.72
      D             1.739

     Hz     ppm     Int.

    314.88   3.516     69
    314.50   3.512     77
    310.38   3.466     80
    309.69   3.458    107
    308.44   3.444    264
    303.13   3.385     88
    302.38   3.377    109
    183.88   2.054     82
    182.25   2.035    138
    181.00   2.021    153
    179.44   2.004    154
    178.56   1.994    138
    178.06   1.989    156
    177.25   1.980    167
    176.44   1.971    173
    175.31   1.958    117
    174.38   1.948     88
    173.25   1.935     77
    171.44   1.915     78
    170.88   1.908    104
    159.00   1.776   1000
    152.31   1.701    931

in CDCl3