MONO-METHYL GLUTARATE(1501-27-5) MS

Product NameMONO-METHYL GLUTARATE

CAS 1501-27-5

Molecular FormulaC6H10O4

Molecular Weight146.14

InChIInChI=1S/C6H10O4/c1-10-6(9)4-2-3-5(7)8/h2-4H2,1H3,(H,7,8)

InChIKey IBMRTYCHDPMBFN-UHFFFAOYSA-N

SmilesC(OC)(=O)CCCC(O)=O

Request For Quotation

MONO-METHYL GLUTARATE(1501-27-5) MS
Mass

MS-NW-6448          
methyl hydrogen glutarate
C6H10O4             (Mass of molecular ion:    146)

   Source Temperature: 260 °C
   Sample Temperature: 190 °C
   Reservoir, 75 eV

      14.0       2.8
      15.0      38.0
      18.0       3.7
      26.0       3.8
      27.0      30.3
      28.0      10.5
      29.0       9.7
      30.0       1.6
      31.0      14.2
      32.0       1.9
      33.0       3.2
      35.0       2.2
      37.0       1.6
      38.0       3.6
      39.0      22.4
      40.0       5.5
      41.0      51.5
      42.0      59.6
      43.0     100.0
      44.0       6.7
      45.0      54.3
      46.0       1.4
      49.0       2.3
      55.0      67.0
      56.0       3.4
      57.0       2.2
      58.0      19.3
      59.0      55.6
      60.0       9.8
      61.0       1.0
      68.0       4.9
      69.0       7.0
      70.0       7.9
      71.0       1.6
      72.0       5.3
      73.0       4.9
      74.0      30.3
      75.0       1.4
      85.0       7.0
      86.0      52.8
      87.0      82.6
      88.0       4.7
      97.0       7.9
      98.0       1.3
      99.0       1.6
     100.0      81.1
     101.0      10.7
     102.0       1.1
     114.0      41.0
     115.0      67.7
     116.0       4.5
     128.0       9.8
     129.0       6.9

90 MHz in CDCl3

MONO-METHYL GLUTARATE(1501-27-5) MS

¹H NMR	89.56 MHz
C₆ H₁₀ O₄	0.05 ml : 0.5 ml CDCl₃
methyl hydrogen glutarate

    Assign.     Shift(ppm)

      A            11.68
      B             3.687
      C             2.43
      D             1.98

     Hz     ppm     Int.

   1046.50  11.685    246
    330.18   3.687   1000
    227.04   2.536     59
    225.93   2.523     75
    224.13   2.503     85
    218.66   2.442    225
    217.04   2.424    193
    214.56   2.396     77
    212.60   2.374    163
    210.55   2.351    141
    189.44   2.116     35
    187.48   2.094     39
    182.52   2.038     82
    181.58   2.028     91
    177.73   1.985     32
    175.26   1.957     94
    174.57   1.950     93
    170.90   1.909     24
    168.16   1.878     52
    167.22   1.868     46

in CDCl3