Welcome to chemicalbook!
+1 (818) 612-2111
Inquriy
Try our best to find the right business for you.
Do not miss inquiry messages Please log in to view all inquiry messages.

Welcome back!

Back ChemicalBook Home>CAS DataBase List>111-11-5More Spectrum> Caprylic acid methyl ester(111-11-5) 1H NMR

Caprylic acid methyl ester(111-11-5) 1H NMR

Molecular FormulaC9H18O2

Molecular Weight158.24

InChIInChI=1S/C9H18O2/c1-3-4-5-6-7-8-9(10)11-2/h3-8H2,1-2H3

InChIKey JGHZJRVDZXSNKQ-UHFFFAOYSA-N

SmilesC(OC)(=O)CCCCCCC


  • Mass

    MS-NW-1743          
    methyl octanoate
    C9H18O2             (Mass of molecular ion:    158)
    

       Source Temperature: 220 °C
       Sample Temperature: 180 °C
       Reservoir, 75 eV
    

          15.0      11.7
          18.0       1.0
          27.0      15.6
          28.0       3.5
          29.0      19.7
          31.0       2.1
          39.0      11.2
          40.0       2.2
          41.0      30.7
          42.0       8.7
          43.0      24.2
          44.0       1.3
          45.0       2.4
          53.0       2.2
          54.0       1.3
          55.0      17.3
          56.0       3.4
          57.0      17.4
          59.0      11.9
          67.0       1.7
          69.0       6.7
          70.0       1.6
          73.0       2.2
          74.0     100.0
          75.0       7.6
          83.0       2.3
          84.0       2.9
          87.0      37.5
          88.0       4.1
          97.0       1.4
          98.0       1.7
         101.0       5.8
         115.0       6.7
         127.0       8.9
         129.0       3.0
         158.0       1.7
    



CCl4 solution



liquid film



4880 A,200 M,liquid



Caprylic acid methyl ester(111-11-5) 1H NMR Atlas of Related Products

×