2688-84-8

2-氨基二苯醚(2688-84-8)Raman光谱

产品名称:2-氨基二苯醚

CAS:2688-84-8

分子式:C12H11NO

分子量: 185.22

InChI:InChI=1S/C12H11NO/c13-11-8-4-5-9-12(11)14-10-6-2-1-3-7-10/h1-9H,13H2

InChIKey: NMFFUUFPJJOWHK-UHFFFAOYSA-N

Smiles:C1(N)=CC=CC=C1OC1=CC=CC=C1

Mass

MS-IW-2142          
o-phenoxyaniline
C12H11NO            (Mass of molecular ion:    185)

   Source Temperature: 220 °C
   Sample Temperature: 160 °C
   Reservoir, 75 eV

      27.0       1.3
      28.0       1.7
      38.0       1.0
      39.0       4.7
      50.0       2.0
      51.0       6.9
      52.0       4.7
      53.0       4.5
      54.0       1.1
      63.0       2.4
      64.0       2.1
      65.0       6.6
      66.0       3.7
      77.0       5.3
      78.0       3.2
      79.0       6.4
      80.0      18.9
      81.0       1.3
      91.0       2.3
      92.0       1.4
     108.0      24.7
     109.0       2.5
     120.0       1.2
     127.0       1.7
     128.0       2.3
     129.0       2.5
     130.0       1.8
     154.0       1.8
     156.0       8.7
     157.0       2.3
     161.0       1.8
     163.0       1.1
     166.0       1.3
     167.0       1.6
     168.0       7.4
     169.0       1.1
     170.0       4.0
     183.0       2.0
     184.0       9.7
     185.0     100.0
     186.0      13.5
     187.0       1.0

400 MHz in CDCl3

¹H NMR	399.65 MHz
C₁₂ H₁₁ N O	0.037 g : 0.5 ml CDCl₃
o-phenoxyaniline

    Assign.     Shift(ppm)

      A             7.289
      B             7.042
      C             6.97
      D             6.96
      E             6.865
      F             6.801
      G             6.704
      J             3.69

     Hz     ppm     Int.

   2923.95   7.317     63
   2921.75   7.311    415
   2920.90   7.309    176
   2919.56   7.306    160
   2917.97   7.302     35
   2916.75   7.299     90
   2915.16   7.295    230
   2914.31   7.293    598
   2913.09   7.290    570
   2910.77   7.284     92
   2907.59   7.276    201
   2906.49   7.273    223
   2905.64   7.271    572
   2903.20   7.265     75
   2822.14   7.062    138
   2821.04   7.059    266
   2819.95   7.057    160
   2814.94   7.044    161
   2814.45   7.043    178
   2813.72   7.041    432
   2812.87   7.039    205
   2812.38   7.038    157
   2807.37   7.025    112
   2806.27   7.022    207
   2805.18   7.020    117
   2794.92   6.994    185
   2793.46   6.990    197
   2789.43   6.980    129
   2788.70   6.978    153
   2787.35   6.975    804
   2786.25   6.972   1000
   2785.64   6.971    635
   2784.18   6.967    215
   2780.64   6.958    236
   2779.66   6.956    568
   2778.56   6.953    787
   2777.59   6.951    608
   2775.02   6.944     71
   2748.90   6.879    306
   2747.56   6.875    307
   2740.97   6.859    400
   2739.50   6.855    378
   2722.53   6.813    334
   2721.07   6.809    374
   2714.72   6.793    284
   2713.13   6.789    297
   2687.38   6.725    222
   2685.79   6.721    205
   2680.05   6.706    241
   2679.44   6.705    241
   2678.47   6.703    246
   2677.86   6.701    209
   2672.00   6.686    154
   2670.53   6.683    144
   1475.59   3.693     75

in CDCl3