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4442-41-5

二苯氧基甲烷(4442-41-5)質(zhì)譜(MS)

產(chǎn)品名稱:二苯氧基甲烷

CAS:4442-41-5

分子式:C13H12O2

分子量: 200.23

InChI:InChI=1S/C13H12O2/c1-3-7-12(8-4-1)14-11-15-13-9-5-2-6-10-13/h1-10H,11H2

InChIKey: VTXLTXPNXYLCQD-UHFFFAOYSA-N

Smiles:C(OC1=CC=CC=C1)OC1=CC=CC=C1

  • 圖譜
    Mass 

    MS-IW-7444          
diphenoxymethane
C13H12O2            (Mass of molecular ion:    200)


       Source Temperature: 220 °C
   Sample Temperature: 150 °C
   Reservoir, 75 eV


          39.0       3.9
      50.0       2.3
      51.0      10.9
      63.0       1.3
      65.0       3.6
      66.0       1.6
      76.0       1.1
      77.0      62.2
      78.0       5.1
      79.0      18.6
      80.0       1.2
      94.0       8.3
     107.0     100.0
     108.0       8.0
     141.0       1.2
     200.0      35.9
     201.0       5.2

400 MHz in CDCl3

  • 圖譜

    1H NMR 399.65 MHz
    C13 H12 O2 0.05 ml : 0.5 ml CDCl3
    diphenoxymethane
    ChemicalStructure 
        Assign.     Shift(ppm)
    
      A             7.262
      B             7.088
      C             6.993
  

         Hz     ppm     Int.


       2913.33   7.290     51
   2911.13   7.285    276
   2910.28   7.283    136
   2908.94   7.279    123
   2906.13   7.272     74
   2903.69   7.266    402
   2902.34   7.263    454
   2900.02   7.257     91
   2897.09   7.250    158
   2895.02   7.244    416
   2892.58   7.238     73
   2839.48   7.105     95
   2838.75   7.104    116
   2837.40   7.100    410
   2836.18   7.097    545
   2835.45   7.095    306
   2834.11   7.092    169
   2830.57   7.083    156
   2829.59   7.081    253
   2828.49   7.078    425
   2827.51   7.075    406
   2824.95   7.069     59
   2802.61   7.013    120
   2801.51   7.010    195
   2800.42   7.008    109
   2795.53   6.995    152
   2795.04   6.994    163
   2794.19   6.992    319
   2793.33   6.990    163
   2787.96   6.977     99
   2786.87   6.974    161
   2785.77   6.971     89
   2265.14   5.668   1000

in CDCl3

  • 圖譜

liquid film

  • 圖譜

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