Mono-methyl succinate(3878-55-5) Raman

Product NameMono-methyl succinate

CAS 3878-55-5

Molecular FormulaC5H8O4

Molecular Weight132.11

InChIInChI=1S/C5H8O4/c1-9-5(8)3-2-4(6)7/h2-3H2,1H3,(H,6,7)

InChIKey JDRMYOQETPMYQX-UHFFFAOYSA-N

SmilesC(OC)(=O)CCC(O)=O

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Mono-methyl succinate(3878-55-5) Raman
Mass

MS-NW-7242          
methyl hydrogen succinate
C5H8O4              (Mass of molecular ion:    132)

   Source Temperature: 210 °C
   Sample Temperature: 190 °C
   Reservoir, 75 eV

      14.0       1.4
      15.0      19.3
      26.0       6.1
      27.0      22.5
      28.0      17.8
      29.0      28.6
      30.0       1.1
      31.0       7.8
      32.0       1.5
      33.0       1.3
      41.0       1.1
      42.0       4.8
      43.0       7.4
      45.0      26.8
      53.0       1.1
      55.0      49.9
      56.0      13.6
      57.0       6.9
      59.0      23.9
      60.0       2.5
      72.0       2.3
      73.0      22.9
      74.0       1.4
      77.0       2.1
      83.0       1.0
      87.0       5.6
      88.0       5.4
     100.0       9.2
     101.0     100.0
     102.0       4.9
     114.0      13.3
     115.0       3.9

90 MHz in CDCl3

Mono-methyl succinate(3878-55-5) Raman

¹H NMR	89.56 MHz
C₅ H₈ O₄	0.039 g : 0.5 ml CDCl₃
methyl hydrogen succinate

    Assign.     Shift(ppm)

      A            11.24
      B             3.707
      C             2.66

     Hz     ppm     Int.

   1007.10  11.245     61
    332.06   3.708   1000
    241.74   2.700     90
    240.45   2.685    215
    238.66   2.665    574
    236.87   2.645    200
    235.58   2.631    104
    231.31   2.583     25
    230.29   2.572     31

in CDCl3