95-55-6

2-氨基苯酚(95-55-6)核磁图(¹³CNMR)

产品名称:2-氨基苯酚

CAS:95-55-6

分子式:C6H7NO

分子量: 109.13

InChI:InChI=1S/C6H7NO/c7-5-3-1-2-4-6(5)8/h1-4,8H,7H2

InChIKey: CDAWCLOXVUBKRW-UHFFFAOYSA-N

Smiles:C1(O)=CC=CC=C1N

Mass

MS-NW-9100          
o-aminophenol
C6H7NO              (Mass of molecular ion:    109)

   Source Temperature: 260 °C
   Sample Temperature: 150 °C
   Reservoir, 75 eV

      18.0       2.0
      27.0       2.7
      28.0       4.0
      31.0       1.6
      38.0       1.6
      39.0       3.2
      40.0       1.5
      40.5       1.7
      41.0       2.1
      50.0       1.6
      51.0       2.6
      52.0       4.4
      53.0       7.1
      54.0       2.8
      54.5       3.1
      55.0       1.2
      63.0       3.8
      64.0       6.1
      65.0       1.7
      80.0      30.5
      81.0       6.1
      91.0       1.7
      92.0       1.2
     108.0       8.8
     109.0     100.0
     110.0       7.1

400 MHz in DMSO-d6

¹H NMR	399.65 MHz
C₆ H₇ N O	0.041 g : 0.5 ml DMSO-d₆
o-aminophenol

    Assign.     Shift(ppm)

      A             8.9
      B             6.649
      C             6.587
      D             6.543
      E             6.400
      F             4.4

     Hz     ppm     Int.

   2662.20   6.662    670
   2660.83   6.658    716
   2657.17   6.649     61
   2654.42   6.642    783
   2653.05   6.639    825
   2638.70   6.603    413
   2637.02   6.599    494
   2634.28   6.592     55
   2631.07   6.584   1000
   2629.24   6.579    988
   2625.12   6.569     51
   2624.66   6.568     51
   2622.07   6.561    560
   2620.70   6.558    550
   2617.65   6.550     57
   2614.90   6.543    757
   2613.53   6.540    684
   2607.27   6.524    354
   2605.74   6.521    320
   2565.77   6.421    487
   2563.78   6.416    481
   2558.44   6.402    599
   2557.98   6.401    578
   2556.61   6.398    591
   2550.81   6.383    347
   2548.98   6.379    331
   1778.87   4.452    139

in DMSO-d6