980-71-2

马来酸溴苯那敏(980-71-2)红外图谱(IR1)

分子式:C20H23BrN2O4

分子量: 435.31

InChI:InChI=1S/C16H19BrN2.C4H4O4/c1-19(2)12-10-15(16-5-3-4-11-18-16)13-6-8-14(17)9-7-13;5-3(6)1-2-4(7)8/h3-9,11,15H,10,12H2,1-2H3;1-2H,(H,5,6)(H,7,8)/b;2-1-

InChIKey: SRGKFVAASLQVBO-BTJKTKAUSA-N

Smiles:C(C1=CC=C(Br)C=C1)(C1=NC=CC=C1)CCN(C)C.C(O)(=O)/C=C\C(O)=O

IR1

IR2

Mass

MS-IW-8280          
3-(p-bromophenyl)-N,N-dimethyl-3-(2-pyridyl)propylamine maleate
C16H19BrN2 C4H4O4   (Mass of molecular ion:    318)

   Source Temperature: 170 °C
   Sample Temperature: 160 °C
   Direct, 75 eV

      26.0       4.8
      27.0       1.2
      28.0       2.0
      30.0       2.9
      42.0       4.7
      43.0       2.1
      44.0       4.0
      45.0       2.2
      51.0       1.7
      54.0       4.9
      56.0       1.7
      57.0       1.4
      58.0      48.6
      59.0       2.1
      63.0       1.2
      71.0       1.5
      72.0      25.6
      73.0       1.3
      77.0       1.4
      78.0       2.1
      89.0       1.2
      93.0       1.1
      95.5       3.4
      98.0       3.5
     115.0       1.7
     117.0       1.3
     118.0       1.3
     139.0       2.1
     140.0       1.6
     164.0       1.0
     165.0       1.7
     166.0       4.1
     167.0      20.6
     168.0      17.1
     169.0      10.8
     170.0       1.3
     180.0       3.4
     181.0       2.3
     190.0       1.3
     191.0       5.8
     192.0       3.7
     193.0       6.8
     194.0       1.6
     203.0       1.5
     246.0      11.2
     247.0     100.0
     248.0      24.1
     249.0      97.0
     250.0      13.0
     260.0       2.4
     262.0       1.9
     271.0      11.1
     272.0       2.3
     273.0      11.2
     274.0       3.5
     276.0       1.4
     299.0       1.4
     301.0       1.4
     314.0       1.0
     316.0       1.1

KBr disk