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Back ChemicalBook Home>CAS DataBase List>625-06-9More Spectrum> 2,4-DIMETHYL-2-PENTANOL(625-06-9) 1H NMR

2,4-DIMETHYL-2-PENTANOL(625-06-9) 1H NMR

Molecular FormulaC7H16O

Molecular Weight116.2

InChIInChI=1S/C7H16O/c1-6(2)5-7(3,4)8/h6,8H,5H2,1-4H3

InChIKey FMLSQAUAAGVTJO-UHFFFAOYSA-N

SmilesCC(C)(O)CC(C)C


  • Mass

    MS-IW-3510          
    2,4-dimethyl-2-pentanol
    C7H16O              (Mass of molecular ion:    116)
    

       Source Temperature: 210 °C
       Sample Temperature: 160 °C
       Reservoir, 75 eV
    

          15.0       1.2
          27.0       4.9
          29.0       4.2
          31.0       9.2
          39.0       5.4
          41.0      15.8
          42.0       1.5
          43.0      20.2
          45.0       7.5
          55.0       4.6
          56.0       4.7
          57.0      17.9
          58.0       4.4
          59.0     100.0
          60.0       4.9
          83.0       5.7
         101.0      16.0
         102.0       1.0
    

400 MHz in CDCl3


  • 1H NMR 399.65 MHz
    C7 H16 O 0.05 ml : 0.5 ml CDCl3
    2,4-dimethyl-2-pentanol
    ChemicalStructure
        Assign.     Shift(ppm)
    A 1.782 B 1.68 C 1.403 D 1.225 E 0.964

         Hz     ppm     Int.
    

        726.07   1.817     25
        719.97   1.802     49
        713.38   1.786     64
        706.79   1.769     54
        700.68   1.754     31
        672.36   1.683     34
        563.72   1.411    285
        557.74   1.396    257
        489.99   1.227   1000
        394.29   0.987     20
        388.55   0.973    812
        381.84   0.956    737
        376.10   0.942     40
    

in CDCl3



liquid film



2,4-DIMETHYL-2-PENTANOL(625-06-9) 1H NMR Atlas of Related Products

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