2-溴苯甲酰胺(4001-73-4)紅外圖譜(IR1)

產(chǎn)品名稱(chēng):2-溴苯甲酰胺

CAS:4001-73-4

分子式:C7H6BrNO

分子量: 200.03

InChI:InChI=1S/C7H6BrNO/c8-6-4-2-1-3-5(6)7(9)10/h1-4H,(H2,9,10)

InChIKey: NHNAEZDWNCRWRW-UHFFFAOYSA-N

Smiles:C(N)(=O)C1=CC=CC=C1Br

Mass

MS-NW-7901          
o-bromobenzamide
C7H6BrNO            (Mass of molecular ion:    199)

   Source Temperature: 180 °C
   Sample Temperature: 120 °C
   Direct, 75 eV

      18.0       1.9
      27.0       1.3
      28.0       1.7
      37.0       3.1
      38.0       6.6
      39.0       3.1
      44.0      12.0
      45.5       2.8
      46.0       1.1
      49.0       2.5
      50.0      25.8
      51.0      11.1
      52.0       2.2
      60.0       1.3
      63.0       1.6
      64.0       1.1
      65.0       4.2
      73.0       2.2
      74.0      10.7
      75.0      25.8
      76.0      25.8
      77.0      17.1
      77.5       1.1
      78.0       1.2
      78.5       1.1
      85.5       1.9
      86.5       2.0
      90.0       1.2
      91.0       1.7
      91.5       1.2
      92.0       1.5
      92.5       1.0
     102.0       3.2
     104.0       2.6
     111.0       2.2
     139.0       6.0
     141.0       2.0
     155.0      32.6
     156.0       3.6
     157.0      31.2
     158.0       3.1
     181.0       1.8
     183.0     100.0
     184.0       8.3
     185.0      96.1
     186.0       7.6
     199.0      59.3
     200.0       5.2
     201.0      58.1
     202.0       5.0

400 MHz in DMSO-d6

¹H NMR	399.65 MHz
C₇ H₆ Br N O	0.039 g : 0.5 ml DMSO-d₆
o-bromobenzamide

    Assign.     Shift(ppm)

      A     *1      7.88
      B             7.634
      C     *1      7.58
      D             7.41
      E             7.333

     Hz     ppm     Int.

   3147.58   7.876    171
   3055.42   7.646    369
   3047.64   7.626    519
   3028.11   7.577    174
   2972.56   7.438     59
   2971.50   7.436     76
   2969.82   7.432     37
   2965.09   7.420    336
   2964.02   7.417    394
   2961.73   7.411    470
   2958.37   7.403   1000
   2954.56   7.393    134
   2954.10   7.392    125
   2951.97   7.387     42
   2943.12   7.365     42
   2938.54   7.353    293
   2935.18   7.345    230
   2932.74   7.339    217
   2930.60   7.333    265
   2929.38   7.330    195
   2927.09   7.325    191
   2924.96   7.319    199
   2921.45   7.311    154

DMSO-d6