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Back ChemicalBook Home>CAS DataBase List>622-08-2More Spectrum> 2-Benzyloxyethanol(622-08-2) MS

2-Benzyloxyethanol(622-08-2) MS

Product Name2-Benzyloxyethanol

CAS622-08-2

Molecular FormulaC9H12O2

Molecular Weight152.19

InChIInChI=1S/C9H12O2/c10-6-7-11-8-9-4-2-1-3-5-9/h1-5,10H,6-8H2

InChIKey CUZKCNWZBXLAJX-UHFFFAOYSA-N

SmilesC(O)COCC1=CC=CC=C1


  • Mass

    MS-NW-6069          
    2-(benzyloxy)ethanol
    C9H12O2             (Mass of molecular ion:    152)
    

       Source Temperature: 260 °C
       Sample Temperature: 190 °C
       Reservoir, 75 eV
    

          27.0       2.3
          28.0       1.6
          29.0       2.0
          31.0       3.7
          39.0       5.4
          41.0       1.5
          43.0       1.2
          45.0       5.0
          50.0       1.5
          51.0       4.1
          52.0       1.2
          63.0       2.4
          65.0      10.5
          77.0       4.5
          78.0       1.3
          79.0       6.2
          89.0       2.9
          90.0       1.9
          91.0     100.0
          92.0      24.5
          93.0       1.6
         105.0       2.4
         106.0       1.5
         107.0      23.4
         108.0       2.4
         151.0       1.5
         152.0      14.4
         153.0       1.5
    

400 MHz in CDCl3


  • 1H NMR 399.65 MHz
    C9 H12 O2 0.05 ml : 0.5 ml CDCl3
    2-(benzyloxy)ethanol
    ChemicalStructure
        Assign.     Shift(ppm)
    A 7.32 B 7.270 C 4.508 D 3.682 E 3.527 F 3.12

         Hz     ppm     Int.
    

       2935.30   7.345     31
       2934.33   7.343     34
       2932.50   7.338     35
       2929.20   7.330    135
       2926.51   7.323    661
       2922.00   7.312   1000
       2917.85   7.302     87
       2914.79   7.294     42
       2913.33   7.290     75
       2909.30   7.280    123
       2906.01   7.272    118
       2904.54   7.268    119
       2900.63   7.258    121
       2897.83   7.251     55
       2895.75   7.246     67
       2892.09   7.237     30
       1801.64   4.509    882
       1476.56   3.695    299
       1474.49   3.690     92
       1472.17   3.684    371
       1470.83   3.681    212
       1468.87   3.676    107
       1467.29   3.672    385
       1413.70   3.538    384
       1411.99   3.534     97
       1410.03   3.529    240
       1408.94   3.526    374
       1406.37   3.520     87
       1404.42   3.515    290
       1245.36   3.117    504
    

in CDCl3



liquid film





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