Undecenoic acid(112-38-9) ¹³C NMR

Product NameUndecenoic acid

CAS 112-38-9

Molecular FormulaC11H20O2

Molecular Weight184.28

InChIInChI=1S/C11H20O2/c1-2-3-4-5-6-7-8-9-10-11(12)13/h2H,1,3-10H2,(H,12,13)

InChIKey FRPZMMHWLSIFAZ-UHFFFAOYSA-N

SmilesC(O)(=O)CCCCCCCCC=C

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Mass

MS-NW-0558          
10-undecenoic acid
C11H20O2            (Mass of molecular ion:    184)

   Source Temperature: 280 °C
   Sample Temperature: 180 °C
   Reservoir, 75 eV

      15.0       1.2
      17.0       2.4
      18.0      11.1
      26.0       1.1
      27.0      17.7
      28.0       3.8
      29.0      21.5
      31.0       2.0
      39.0      19.2
      40.0       3.1
      41.0      63.5
      42.0      13.4
      43.0      17.6
      44.0       7.4
      45.0       8.1
      51.0       1.3
      53.0       6.9
      54.0      15.1
      55.0     100.0
      56.0      21.4
      57.0       6.8
      58.0       2.0
      59.0       6.8
      60.0      27.7
      61.0       2.9
      65.0       1.1
      66.0       1.4
      67.0      15.8
      68.0      27.2
      69.0      51.9
      70.0      14.1
      71.0       5.2
      73.0      25.9
      74.0       2.8
      79.0       3.5
      80.0       4.2
      81.0      14.6
      82.0      33.3
      83.0      39.6
      84.0      22.7
      85.0       3.7
      86.0       1.1
      87.0       8.3
      88.0       1.1
      91.0       1.0
      93.0       2.1
      94.0       3.7
      95.0      10.2
      96.0      25.0
      97.0      17.5
      98.0      14.1
      99.0       3.7
     100.0       9.9
     101.0       8.8
     102.0       1.3
     106.0       1.0
     107.0       1.6
     109.0       4.4
     110.0       8.7
     111.0       5.1
     112.0       2.3
     113.0       3.1
     114.0       9.5
     115.0       2.3
     119.0       1.7
     122.0       7.5
     123.0       8.2
     124.0      18.1
     125.0       5.6
     127.0       2.5
     128.0       1.0
     137.0       5.0
     138.0       3.2
     141.0       1.2
     148.0       2.7
     166.0       5.1