627-64-5

富马酰胺(627-64-5)质谱(MS)

产品名称:富马酰胺

CAS:627-64-5

分子式:C4H6N2O2

分子量: 114.1

InChI:InChI=1S/C4H6N2O2/c5-3(7)1-2-4(6)8/h1-2H,(H2,5,7)(H2,6,8)/b2-1+

InChIKey: BSSNZUFKXJJCBG-OWOJBTEDSA-N

Smiles:C(N)(=O)/C=C/C(N)=O

IR1

IR2

Mass

MS-NW-1532          
fumaramide
C4H6N2O2            (Mass of molecular ion:    114)

   Source Temperature: 240 °C
   Sample Temperature: 290 °C
   Direct, 75 eV

      15.0       2.0
      16.0       3.4
      17.0       3.8
      18.0       6.3
      25.0       1.9
      26.0      13.8
      27.0       9.7
      28.0       6.8
      29.0       2.4
      38.0       1.1
      39.0       1.4
      40.0       2.2
      41.0       5.1
      42.0       4.5
      43.0       4.8
      44.0     100.0
      45.0       8.4
      51.0       3.5
      52.0       8.0
      53.0      20.0
      54.0      11.3
      55.0       9.4
      57.0       2.1
      68.0       2.3
      69.0       3.6
      70.0      92.5
      71.0      15.5
      78.0       2.2
      80.0       4.2
      81.0       2.0
      82.0       2.3
      83.0       1.3
      86.0       6.0
      87.0       3.1
      96.0       1.6
      97.0       5.2
      98.0      41.5
      99.0       5.2
     114.0      29.1
     115.0       1.9

KBr disc