14565-43-6

Formyl-beta-Alanine(14565-43-6) MS

Product NameFormyl-beta-Alanine

CAS 14565-43-6

Molecular FormulaC4H7NO3

Molecular Weight117.1

InChIInChI=1S/C4H7NO3/c6-3-5-2-1-4(7)8/h3H,1-2H2,(H,5,6)(H,7,8)

InChIKey MSEDDDMEHWJQEK-UHFFFAOYSA-N

SmilesC(O)(=O)CCNC=O

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IR1

IR2

IR3

Formyl-beta-Alanine(14565-43-6) MS
Mass

MS-NW-1246          
N-formyl-beta-alanine
C4H7NO3             (Mass of molecular ion:    117)

   Source Temperature: 260 °C
   Sample Temperature: 180 °C
   Reservoir, 75 eV

      26.0       4.7
      27.0      14.3
      28.0      21.6
      29.0      15.0
      30.0     100.0
      31.0       2.4
      32.0       1.2
      39.0       1.3
      40.0       2.0
      41.0       4.3
      42.0      12.9
      43.0      17.0
      44.0      24.4
      45.0      13.7
      46.0       6.4
      55.0      14.9
      56.0       2.3
      57.0       1.0
      58.0      26.9
      59.0       1.1
      60.0       5.4
      69.0       1.0
      70.0       8.5
      71.0      33.1
      72.0      11.5
      73.0       4.2
      81.0       1.2
      88.0       9.9
      89.0      21.4
      99.0       9.9
     100.0       2.3

KBr disc

liquid film

nujol mull

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