BROMOSUCCINIC ACID(923-06-8) IR1

Product NameBROMOSUCCINIC ACID

CAS 923-06-8

Molecular FormulaC4H5BrO4

Molecular Weight196.98

InChIInChI=1S/C4H5BrO4/c5-2(4(8)9)1-3(6)7/h2H,1H2,(H,6,7)(H,8,9)

InChIKey QQWGVQWAEANRTK-UHFFFAOYSA-N

SmilesC(O)(=O)C(Br)CC(O)=O

Request For Quotation

BROMOSUCCINIC ACID(923-06-8) IR1
Mass

MS-NW-6608          
bromosuccinic acid
C4H5BrO4            (Mass of molecular ion:    196)

   Source Temperature: 180 °C
   Sample Temperature: 140 °C
   Direct, 75 eV

      13.0       1.2
      14.0       2.7
      15.0       6.6
      17.0       2.6
      18.0      11.4
      19.0       1.0
      25.0       4.6
      26.0      29.8
      27.0     100.0
      28.0      16.6
      29.0      11.0
      31.0       1.3
      41.0       2.7
      42.0      11.5
      43.0      26.5
      44.0      14.7
      45.0      62.4
      46.0       5.9
      47.0       1.7
      53.0       8.0
      54.0       8.5
      55.0      58.5
      56.0       4.1
      57.0       1.2
      71.0      38.0
      72.0      17.4
      73.0      68.5
      74.0       2.8
      79.0      10.7
      80.0      27.6
      81.0      11.0
      82.0      26.7
      88.0       1.1
      89.0       1.7
      98.0       6.6
      99.0       8.4
     100.0       1.1
     105.0       2.5
     106.0      20.9
     107.0       8.4
     108.0      20.3
     109.0       6.9
     116.0       1.7
     123.0       1.1
     125.0       1.1
     133.0       4.3
     134.0       1.1
     135.0       4.4
     136.0       1.0
     150.0      27.3
     151.0       3.5
     152.0      34.8
     153.0       3.6
     154.0       8.4
     178.0      50.6
     179.0       3.5
     180.0      50.3
     181.0       3.4

400 MHz in DMSO-d6

BROMOSUCCINIC ACID(923-06-8) IR1

¹H NMR	399.65 MHz
C₄ H₅ Br O₄	saturated in DMSO-d₆
bromosuccinic acid

    Assign.     Shift(ppm)

      A             4.523
      B     *1      3.077
      C     *1      2.894

     Hz     ppm     Int.

   1815.43   4.543    768
   1809.08   4.527    977
   1806.88   4.522    940
   1800.54   4.506    829
   1244.38   3.114    649
   1235.84   3.093    618
   1227.29   3.071    959
   1218.75   3.050    955
   1166.99   2.921    950
   1160.64   2.905   1000
   1149.90   2.878    698
   1143.55   2.862    632

in DMSO-d6