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Back ChemicalBook Home>CAS DataBase List>13826-35-2More Spectrum> 3-Phenoxybenzyl alcohol(13826-35-2) MS

3-Phenoxybenzyl alcohol(13826-35-2) MS

Molecular FormulaC13H12O2

Molecular Weight200.23

InChIInChI=1S/C13H12O2/c14-10-11-5-4-8-13(9-11)15-12-6-2-1-3-7-12/h1-9,14H,10H2

InChIKey KGANAERDZBAECK-UHFFFAOYSA-N

SmilesC1(CO)=CC=CC(OC2=CC=CC=C2)=C1


  • Mass

    MS-NW-6015          
    m-phenoxybenzyl alcohol
    C13H12O2            (Mass of molecular ion:    200)
    

       Source Temperature: 250 °C
       Sample Temperature: 190 °C
       Reservoir, 75 eV
    

          18.0       1.5
          27.0       3.0
          28.0       2.3
          29.0       1.8
          31.0       2.2
          38.0       2.0
          39.0       9.4
          40.0       1.5
          41.0       2.0
          50.0       5.4
          51.0      19.8
          52.0       2.6
          53.0       2.0
          55.0       1.9
          62.0       1.3
          63.0       5.6
          64.0       2.6
          65.0      13.5
          66.0       4.0
          67.0       1.6
          74.0       1.5
          75.0       1.7
          76.0       4.1
          77.0      26.8
          78.0       6.1
          79.0      20.0
          80.0       1.4
          89.0       7.4
          90.0       1.5
          90.5       1.0
          91.0       4.5
          93.0      12.4
          94.0      24.8
          95.0       5.7
          99.0       1.3
          99.5       1.2
         105.0       3.5
         106.0       1.4
         107.0      17.0
         108.0       1.5
         115.0       6.1
         121.0       1.5
         122.0       5.1
         123.0       1.1
         127.0       1.3
         128.0       3.1
         129.0       1.3
         139.0       1.8
         141.0       7.6
         142.0       2.0
         143.0       1.0
         152.0       3.7
         153.0       9.2
         154.0       2.0
         155.0       1.7
         168.0       1.8
         169.0       5.9
         170.0       1.4
         171.0      11.8
         172.0       1.9
         181.0      11.5
         182.0       2.6
         183.0       4.7
         184.0       2.4
         197.0       2.5
         198.0       4.7
         199.0       6.2
         200.0     100.0
         201.0      14.7
         202.0       1.6
    

400 MHz in CDCl3


  • 1H NMR 399.65 MHz
    C13 H12 O2 0.05 ml : 0.5 ml CDCl3
    m-phenoxybenzyl alcohol
    ChemicalStructure
        Assign.     Shift(ppm)
    A 7.270 B 7.229 C 7.053 D 6.99 E 6.96 F 6.94 G 6.869 J 4.492 K 3.07

         Hz     ppm     Int.
    

       2916.14   7.297    121
       2913.82   7.291    526
       2912.96   7.289    289
       2911.74   7.286    238
       2908.81   7.279    166
       2907.35   7.275    372
       2906.37   7.273    807
       2905.27   7.270    736
       2902.95   7.264    164
       2899.78   7.256    326
       2898.56   7.253    385
       2897.83   7.251    791
       2895.39   7.245    164
       2889.16   7.230    615
       2881.23   7.210    416
       2826.90   7.074    215
       2825.68   7.071    384
       2824.58   7.068    243
       2819.70   7.056    248
       2819.09   7.054    287
       2818.36   7.053    582
       2817.63   7.051    322
       2816.89   7.049    238
       2812.01   7.037    171
       2810.91   7.034    295
       2809.81   7.031    180
       2800.54   7.008    278
       2799.56   7.006    386
       2798.95   7.004    404
       2797.97   7.002    321
       2792.97   6.989    241
       2791.99   6.987    329
       2791.38   6.985    353
       2790.41   6.983    277
       2787.72   6.976    194
       2786.99   6.974    226
       2785.64   6.971    833
       2784.55   6.968    960
       2783.81   6.966    575
       2782.35   6.962    295
       2778.93   6.954    326
       2777.95   6.951    537
       2776.98   6.949    979
       2775.88   6.946   1000
       2774.90   6.944    595
       2774.05   6.942    580
       2772.46   6.938    432
       2750.85   6.884    279
       2750.37   6.882    286
       2749.88   6.881    296
       2748.29   6.877    250
       2747.92   6.876    241
       2747.31   6.875    237
       2742.68   6.863    244
       2742.19   6.862    249
       2741.70   6.861    257
       2740.23   6.857    235
       2739.75   6.856    224
       2739.26   6.855    219
       1798.34   4.500    700
       1792.72   4.486    702
       1233.15   3.086    193
       1227.42   3.072    448
       1221.68   3.057    193
    

in CDCl3



liquid film



4880 A,200 M,liquid



3-Phenoxybenzyl alcohol(13826-35-2) MS Atlas of Related Products

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