2-萘酚(135-19-3)ESR圖譜

產(chǎn)品名稱:2-萘酚

CAS:135-19-3

分子式:C10H8O

分子量: 144.17

InChI:InChI=1S/C10H8O/c11-10-6-5-8-3-1-2-4-9(8)7-10/h1-7,11H

InChIKey: JWAZRIHNYRIHIV-UHFFFAOYSA-N

Smiles:C1=C2C(C=CC=C2)=CC=C1O

Mass

MS-NW-1515          
2-naphthol
C10H8O              (Mass of molecular ion:    144)

   Source Temperature: 250 °C
   Sample Temperature: 170 °C
   Reservoir, 75 eV

      27.0       1.2
      38.0       2.3
      39.0       6.3
      50.0       4.4
      51.0       4.9
      53.0       1.1
      57.0       1.6
      57.5       2.5
      58.0       1.8
      61.0       1.9
      62.0       5.7
      63.0      11.0
      64.0       2.0
      65.0       4.4
      72.0       3.2
      74.0       3.5
      75.0       2.9
      76.0       1.4
      77.0       1.1
      86.0       2.1
      87.0       3.5
      88.0       2.8
      89.0      10.8
      90.0       1.5
     113.0       2.6
     114.0       3.9
     115.0      70.7
     116.0      24.1
     117.0       1.9
     126.0       1.2
     143.0       1.3
     144.0     100.0
     145.0      10.9

400 MHz in CDCl3

¹H NMR	399.65 MHz
C₁₀ H₈ O	20.1 mg : 0.5 ml CDCl₃
2-naphthol

    Assign.     Shift(ppm)

      A             7.75
      B             7.74
      C             7.655
      D             7.417
      E             7.321
      F             7.122
      G             7.089
      J             5.19
     
     J(F,G)=2.6HZ. J(B,G)=8.6HZ.

     Hz     ppm     Int.

   3104.61   7.769    391
   3104.13   7.768    374
   3096.44   7.748    903
   3095.70   7.747   1000
   3091.67   7.736     66
   3087.16   7.725    582
   3064.33   7.668    391
   3063.60   7.666    362
   3056.03   7.647    470
   3055.30   7.645    437
   2972.66   7.439    237
   2971.31   7.435    239
   2965.70   7.421    358
   2964.48   7.418    468
   2963.13   7.415    223
   2957.52   7.401    296
   2956.30   7.398    264
   2933.47   7.341    357
   2932.25   7.338    348
   2926.76   7.324    289
   2925.42   7.320    530
   2924.07   7.317    329
   2918.46   7.303    249
   2917.24   7.300    224
   2848.14   7.127    496
   2845.70   7.121    716
   2838.50   7.103    637
   2835.94   7.097    383
   2829.83   7.081    539
   2827.27   7.075    406

in CDCl3