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Back ChemicalBook Home>CAS DataBase List>821-55-6More Spectrum> 2-Nonanone(821-55-6) 13C NMR

2-Nonanone(821-55-6) 13C NMR

Product Name2-Nonanone

CAS821-55-6

Molecular FormulaC9H18O

Molecular Weight142.24

InChIInChI=1S/C9H18O/c1-3-4-5-6-7-8-9(2)10/h3-8H2,1-2H3

InChIKey VKCYHJWLYTUGCC-UHFFFAOYSA-N

SmilesCC(=O)CCCCCCC


  • Mass

    MS-NW-4043          
    2-nonanone
    C9H18O              (Mass of molecular ion:    142)
    

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

          15.0       2.7
          27.0       7.8
          28.0       1.6
          29.0       9.2
          39.0       5.5
          40.0       1.0
          41.0      14.9
          42.0       3.7
          43.0      73.2
          44.0       1.9
          45.0       1.0
          53.0       1.2
          55.0       6.3
          56.0       3.4
          57.0      21.8
          58.0     100.0
          59.0      21.2
          67.0       1.5
          69.0       1.8
          71.0      21.8
          72.0       1.6
          82.0       3.2
          83.0       1.0
          84.0       3.8
          85.0       3.8
          99.0       1.7
         100.0       1.4
         113.0       1.2
         127.0       2.5
         142.0       5.1
    

90 MHz in CDCl3


  • 1H NMR 89.56 MHz
    C9 H18 O 0.04 ml : 0.5 ml CDCl3
    2-nonanone
    ChemicalStructure
        Assign.     Shift(ppm)
    A 2.40 B 2.13 C 1.57 D 1.27 E 0.88

         Hz     ppm     Int.
    

        223.56   2.497     53
        216.75   2.421    125
        209.38   2.338    104
        190.44   2.127   1000
        147.75   1.650     30
        140.44   1.569     42
        140.13   1.565     42
        137.75   1.539     33
        137.38   1.534     32
        136.38   1.523     31
        135.44   1.513     32
        134.94   1.507     32
        133.88   1.495     32
        132.81   1.483     35
        126.88   1.417     41
        113.75   1.271    434
         83.94   0.938     70
         81.44   0.910     58
         78.69   0.879    237
         72.56   0.811     52
    

in CDCl3



liquid film



4880 A,200 M,liquid



2-Nonanone(821-55-6) 13C NMR Atlas of Related Products

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