6941-75-9

4-溴邻苯二甲酰亚胺(6941-75-9)红外图谱(IR2)

产品名称:4-溴邻苯二甲酰亚胺

CAS:6941-75-9

分子式:C8H4BrNO2

分子量: 226.03

InChI:InChI=1S/C8H4BrNO2/c9-4-1-2-5-6(3-4)8(12)10-7(5)11/h1-3H,(H,10,11,12)

InChIKey: GNYICZVGHULCHE-UHFFFAOYSA-N

Smiles:C1(=O)C2=C(C=C(Br)C=C2)C(=O)N1

Mass

MS-KW-0514          
4-bromophthalimide
C8H4BrNO2           (Mass of molecular ion:    225)

   Source Temperature: 130 °C
   Sample Temperature: 130 °C
   Direct, 75 eV

      28.0       4.9
      37.0       8.9
      37.5       2.6
      38.0       4.1
      44.0       1.1
      44.5       2.8
      45.0       1.3
      49.0       3.1
      50.0       6.8
      50.5       1.3
      51.0       4.0
      52.0       1.2
      53.0       1.6
      59.0       2.2
      61.0       2.5
      62.0       3.1
      63.0       3.7
      70.0       1.9
      72.0       1.1
      73.0      10.8
      74.0      43.1
      75.0      77.2
      76.0       5.7
      77.0       7.6
      78.0       6.2
      84.5       4.2
      85.5       4.1
      90.0       1.0
      91.0       2.0
      92.0       1.7
      98.5       2.0
      99.5       2.6
     100.0       1.2
     101.0       1.2
     102.0      11.6
     103.0       9.6
     104.0       1.1
     106.0       1.0
     153.0       2.0
     154.0      42.6
     155.0       4.8
     156.0      41.6
     157.0       3.0
     168.0       2.2
     170.0       3.0
     181.0      24.6
     182.0      53.2
     183.0      27.9
     184.0      51.7
     185.0       4.0
     225.0     100.0
     226.0       9.5
     227.0      98.0
     228.0       9.4

400 MHz in DMSO-d6

¹H NMR	399.65 MHz
C₈H₄BrNO₂	0.039 g : 0.5 ml DMSO-d₆
4-bromophthalimide

    Assign.     Shift(ppm)

     A          11.5
     B           8.014
     C           7.980
     D           7.757

     Hz     ppm     Int.

   4594.68  11.493     98
   3208.75   8.027    437
   3207.10   8.023    562
   3200.87   8.007    487
   3199.22   8.003    690
   3190.98   7.982   1000
   3189.88   7.980    712
   3189.33   7.978    763
   3104.33   7.766    842
   3096.46   7.746    711

in DMSO-d6