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Back ChemicalBook Home>CAS DataBase List>36887-04-4More Spectrum> 3-METHOXY-1,2-PROPANEDIOL(36887-04-4) Raman

3-METHOXY-1,2-PROPANEDIOL(36887-04-4) Raman

Molecular FormulaC4H10O3

Molecular Weight106.12

InChIInChI=1S/C4H10O3/c1-7-3-4(6)2-5/h4-6H,2-3H2,1H3

InChIKey PSJBSUHYCGQTHZ-UHFFFAOYSA-N

SmilesC(O)(CO)COC


  • Mass

    MS-NW-2950          
    3-methoxy-1,2-propanediol
    C4H10O3             (Mass of molecular ion:    106)
    

       Source Temperature: 270 °C
       Sample Temperature: 180 °C
       Reservoir, 75 eV
    

          14.0       1.0
          15.0      21.2
          18.0       2.2
          19.0       2.8
          26.0       1.0
          27.0       4.9
          28.0       4.6
          29.0      13.8
          30.0       1.4
          31.0      22.4
          32.0       1.1
          33.0      10.8
          42.0       2.7
          43.0      43.0
          44.0      32.9
          45.0     100.0
          46.0       4.0
          47.0       5.1
          55.0       1.1
          56.0       1.5
          57.0       3.2
          58.0       2.5
          59.0       1.4
          60.0       6.8
          61.0      21.5
          63.0       2.0
          71.0       1.1
          74.0       4.2
          75.0      35.7
          76.0       8.5
          87.0       1.1
          88.0       4.6
    

90 MHz in CDCl3


  • 1H NMR 89.56 MHz
    C4 H10 O3 9.7 mol% in CDCl3
    3-methoxy-1,2-propanediol
    ChemicalStructure
        Assign.     Shift(ppm)
    A 3.379 B *1 3.46 C *1 3.41 D *2 3.56 E *2 3.65 F 3.86 G 3.95

         Hz     ppm     Int.
    

        353.31   3.945    197
        347.31   3.878     28
        345.31   3.856     23
        341.44   3.813     24
        340.56   3.803     23
        326.44   3.645     85
        324.94   3.629     94
        322.94   3.606     69
        318.75   3.560     49
        315.56   3.524     28
        310.13   3.463    212
        306.94   3.428     32
        305.06   3.407    136
        302.63   3.380   1000
    

in CDCl3



liquid film



4880 A,200 M,liquid



3-METHOXY-1,2-PROPANEDIOL(36887-04-4) Raman Atlas of Related Products

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