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Back ChemicalBook Home>CAS DataBase List>112-47-0More Spectrum> 1,10-Decanediol(112-47-0) 13C NMR

112-47-0

1,10-Decanediol(112-47-0) 13C NMR

Product Name1,10-Decanediol

CAS112-47-0

Molecular FormulaC10H22O2

Molecular Weight174.28

InChIInChI=1S/C10H22O2/c11-9-7-5-3-1-2-4-6-8-10-12/h11-12H,1-10H2

InChIKey FOTKYAAJKYLFFN-UHFFFAOYSA-N

SmilesC(O)CCCCCCCCCO

  • 1,10-Decanediol(112-47-0) <sup>13</sup>C NMR
    Mass

    MS-NW-0343          
    1,10-decanediol
    C10H22O2            (Mass of molecular ion:    174)
    

       Source Temperature: 170 °C
       Sample Temperature: 120 °C
       Direct, 75 eV
    

          19.0       1.1
          27.0      13.7
          28.0       4.4
          29.0      22.4
          31.0      37.0
          39.0      11.3
          40.0       2.7
          41.0      73.7
          42.0      22.2
          43.0      33.2
          44.0       7.2
          45.0       5.7
          53.0       5.7
          54.0      45.8
          55.0     100.0
          56.0      29.3
          57.0      16.7
          58.0       2.5
          66.0       9.5
          67.0      67.9
          68.0      88.7
          69.0      50.4
          70.0      19.3
          71.0      13.6
          72.0       2.6
          73.0       3.9
          79.0       2.1
          80.0       2.1
          81.0      49.1
          82.0      79.8
          83.0      27.8
          84.0      10.1
          85.0       8.9
          86.0       2.0
          87.0       1.1
          94.0       1.6
          95.0      36.6
          96.0      38.6
          97.0      15.9
          98.0       7.4
          99.0       4.6
         100.0       1.0
         109.0      15.5
         110.0      19.7
         111.0       2.4
         112.0       1.1
         113.0       2.4
         123.0       1.1
         126.0       5.2
         138.0       1.8
    

90 MHz in CDCl3

  • 1,10-Decanediol(112-47-0) <sup>13</sup>C NMR

    1H NMR 89.56 MHz
    C10 H22 O2 0.039 g : 0.5 ml CDCl3
    1,10-decanediol
    ChemicalStructure
        Assign.     Shift(ppm)
    A 3.63 B 1.57 C 1.47 D 1.31

         Hz     ppm     Int.
    

        331.69   3.704    174
        329.06   3.675     62
        325.38   3.634    497
        322.00   3.596     39
        319.13   3.564    250
        151.75   1.695     24
        150.81   1.684     27
        149.69   1.672     35
        149.06   1.665     38
        146.38   1.635     74
        145.63   1.627     75
        145.00   1.620     70
        144.44   1.613     72
        139.69   1.560    126
        136.38   1.523    101
        131.25   1.466    582
        127.00   1.419    158
        125.25   1.399    167
        124.44   1.390    173
        117.13   1.308   1000
    

in CDCl3

  • 1,10-Decanediol(112-47-0) <sup>13</sup>C NMR

KBr disc

  • 1,10-Decanediol(112-47-0) <sup>13</sup>C NMR

nujol mull

  • 1,10-Decanediol(112-47-0) <sup>13</sup>C NMR

  • 1,10-Decanediol(112-47-0) <sup>13</sup>C NMR

1,10-Decanediol(112-47-0) 13C NMR Atlas of Related Products

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