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Back ChemicalBook Home>CAS DataBase List>101072-54-2More Spectrum> N-Chloroacetyl-DL-2-amino-n-butyric acid (alpha-)(101072-54-2) MS

101072-54-2

N-Chloroacetyl-DL-2-amino-n-butyric acid (alpha-)(101072-54-2) MS

Molecular FormulaC6H10ClNO3

Molecular Weight179.6

InChIInChI=1S/C6H10ClNO3/c1-2-4(6(10)11)8-5(9)3-7/h4H,2-3H2,1H3,(H,8,9)(H,10,11)

InChIKey CLYGVTIFEIIGIX-UHFFFAOYSA-N

SmilesC(O)(=O)C(NC(CCl)=O)CC

  • N-Chloroacetyl-DL-2-amino-n-butyric acid (alpha-)(101072-54-2) MS
    Mass

    MS-NW-2275          
    N-chloroacetyl-DL-alpha-aminobutyric acid
    C6H10ClNO3          (Mass of molecular ion:    179)
    

       Source Temperature: 160 °C
       Sample Temperature: 120 °C
       Direct, 75 eV
    

          14.0       1.1
          15.0       2.1
          18.0       3.3
          26.0       1.6
          27.0       7.7
          28.0      19.6
          29.0       4.1
          30.0       4.5
          31.0       1.2
          36.0       3.6
          38.0       1.2
          39.0       3.2
          40.0       1.0
          41.0      13.1
          42.0       7.7
          43.0       6.5
          44.0       2.7
          45.0       5.0
          46.0       1.2
          49.0       9.7
          51.0       3.5
          54.0       1.2
          55.0       1.5
          56.0       8.5
          57.0       3.9
          58.0     100.0
          59.0       4.0
          68.0       1.4
          69.0       2.2
          70.0       1.5
          71.0       2.7
          74.0      25.4
          76.0       1.0
          77.0      10.4
          79.0       3.4
          82.0       1.0
          84.0       8.3
          86.0       1.6
          87.0       2.5
          94.0       5.7
          96.0       1.7
          98.0       1.4
          99.0       1.5
         100.0       4.8
         102.0       7.7
         133.0       3.5
         134.0      65.3
         135.0       5.5
         136.0      21.7
         137.0       1.4
         144.0       1.4
         150.0       1.8
         151.0       2.2
         179.0       4.0
         181.0       1.3
    

in DMSO-d6

  • N-Chloroacetyl-DL-2-amino-n-butyric acid (alpha-)(101072-54-2) MS

KBr disc

  • N-Chloroacetyl-DL-2-amino-n-butyric acid (alpha-)(101072-54-2) MS

nujol mull

  • N-Chloroacetyl-DL-2-amino-n-butyric acid (alpha-)(101072-54-2) MS

N-Chloroacetyl-DL-2-amino-n-butyric acid (alpha-)(101072-54-2) MS Atlas of Related Products

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