N-ACETYLMURAMIC ACID(10597-89-4) MS

Molecular FormulaC11H19NO8

Molecular Weight293.27

InChIInChI=1S/C11H19NO8/c1-4(10(16)17)19-9-7(12-5(2)14)11(18)20-6(3-13)8(9)15/h4,6-9,11,13,15,18H,3H2,1-2H3,(H,12,14)(H,16,17)/t4?,6-,7-,8-,9-,11+/m1/s1

InChIKey MNLRQHMNZILYPY-IWLMJBTDSA-N

SmilesC(O)(=O)C(O[C@@H]1[C@@H](NC(C)=O)[C@@H](O)O[C@H](CO)[C@H]1O)C

Request For Quotation

IR1

Raman

Mass

MS-IW-2321          
(+)-N-acetylmuramic acid
C11H19NO8           (Mass of molecular ion:    293)

   Source Temperature: 140 °C
   Sample Temperature: 170 °C
   Direct, 75 eV

      14.0       1.4
      15.0       5.3
      17.0       3.8
      18.0      17.4
      19.0       5.2
      26.0       2.0
      27.0       9.1
      28.0       5.4
      29.0      14.1
      30.0       1.9
      31.0       3.5
      32.0       1.0
      39.0       1.6
      41.0       3.4
      42.0       7.6
      43.0      51.3
      44.0      10.5
      45.0     100.0
      46.0       3.6
      47.0       1.0
      53.0       1.3
      54.0       1.3
      55.0       2.8
      56.0       3.1
      57.0       1.2
      58.0       1.3
      59.0       7.7
      60.0      20.6
      61.0       1.2
      68.0       1.5
      69.0       2.0
      70.0       1.4
      71.0       1.0
      72.0       6.1
      73.0       1.3
      74.0       1.0
      75.0       1.1
      80.0       1.1
      81.0       1.7
      83.0       2.4
      84.0       3.7
      85.0       2.1
      86.0       1.3
      87.0       1.3
      96.0       3.7
      97.0       3.5
      98.0       2.2
     100.0       2.0
     101.0       1.9
     108.0       1.0
     109.0       1.0
     112.0       1.7
     113.0       1.0
     114.0       6.5
     115.0       1.0
     125.0       4.1
     126.0       2.6
     138.0       1.2
     142.0       1.3
     143.0       1.0
     144.0       1.3
     157.0       1.0
     167.0       1.1
     186.0       1.9

KBr disc