106-79-6

Dimethyl sebacate(106-79-6) ¹³C NMR

Product NameDimethyl sebacate

CAS 106-79-6

Molecular FormulaC12H22O4

Molecular Weight230.3

InChIInChI=1S/C12H22O4/c1-15-11(13)9-7-5-3-4-6-8-10-12(14)16-2/h3-10H2,1-2H3

InChIKey ALOUNLDAKADEEB-UHFFFAOYSA-N

SmilesC(OC)(=O)CCCCCCCCC(OC)=O

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Dimethyl sebacate(106-79-6) <sup>13</sup>C NMR
Mass

MS-NW-0549          
dimethyl sebacate
C12H22O4            (Mass of molecular ion:    230)

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

      15.0      30.3
      17.0       1.2
      18.0       5.9
      27.0      13.6
      28.0       5.8
      29.0      18.8
      31.0       4.6
      39.0      11.3
      40.0       2.4
      41.0      45.8
      42.0       9.0
      43.0      43.6
      44.0       2.2
      45.0       6.3
      53.0       4.3
      54.0       4.4
      55.0      72.8
      56.0       8.7
      57.0       6.8
      58.0       1.0
      59.0      29.8
      60.0       1.2
      67.0      10.4
      68.0       6.1
      69.0      36.3
      70.0       6.0
      71.0       3.5
      73.0       9.8
      74.0     100.0
      75.0       6.5
      79.0       4.7
      80.0       5.0
      81.0      11.3
      82.0       5.0
      83.0      30.3
      84.0      58.4
      85.0       5.3
      87.0      35.7
      88.0       6.4
      91.0       1.1
      93.0       3.3
      94.0       4.5
      95.0       7.9
      96.0       9.4
      97.0      43.8
      98.0      80.5
      99.0       5.9
     100.0       1.2
     101.0      10.6
     102.0       1.3
     106.0       1.5
     107.0       5.1
     109.0       3.1
     110.0       7.3
     111.0      11.0
     112.0      10.8
     113.0       2.5
     114.0       2.7
     115.0       9.4
     116.0       1.2
     119.0       1.4
     120.0       2.8
     121.0       9.6
     122.0       2.1
     123.0       2.5
     124.0       8.3
     125.0      66.2
     126.0       6.4
     127.0       1.9
     128.0       1.1
     129.0       2.1
     130.0       1.1
     135.0       1.8
     137.0       2.5
     138.0      34.5
     139.0      17.7
     140.0       1.8
     142.0       1.7
     143.0       1.2
     144.0       4.5
     148.0       4.9
     149.0       2.2
     151.0       1.0
     152.0       1.9
     153.0       3.6
     154.0       1.8
     155.0       1.0
     156.0       2.0
     157.0      48.0
     158.0       5.2
     165.0       1.0
     166.0      30.7
     167.0       5.2
     170.0       4.0
     171.0       3.1
     180.0       1.2
     185.0       3.8
     198.0       3.6
     199.0      43.0
     200.0       5.2
     213.0       1.7
     227.0       2.7