2-溴苄醇

产品名称 2-溴苄醇

CAS号18982-54-2

分子式C7H7BrO

分子量187.03

¹³CNMR

Mass

MS-NW-6229          
o-bromobenzyl alcohol
C7H7BrO             (Mass of molecular ion:    186)

   Source Temperature: 260 °C
   Sample Temperature: 190 °C
   Reservoir, 75 eV

      18.0       3.5
      26.0       1.3
      27.0       4.7
      28.0       3.1
      29.0       5.6
      31.0       4.5
      37.0       2.6
      38.0       4.8
      39.0      10.0
      40.0       1.0
      43.0       1.3
      44.0       1.0
      49.0       1.8
      50.0      16.3
      51.0      24.4
      52.0       6.3
      53.0       9.7
      53.5       2.7
      61.0       2.2
      62.0       3.9
      63.0       7.2
      64.0       1.7
      73.0       1.5
      74.0       5.5
      75.0       8.5
      76.0       8.9
      77.0      88.2
      78.0      27.3
      79.0     100.0
      80.0       6.9
      82.0       1.0
      86.0       1.0
      89.0      10.5
      90.0       8.2
      91.0       1.4
      92.5       1.0
      93.5       1.0
     105.0      12.8
     106.0       2.1
     107.0      91.1
     108.0       7.6
     155.0       3.0
     157.0       9.9
     158.0       1.2
     159.0       6.9
     169.0       5.3
     170.0       1.1
     171.0       5.1
     183.0       2.0
     185.0       8.6
     186.0      51.0
     187.0      10.8
     188.0      49.4
     189.0       4.0

400 MHz in CDCl3

90 MHz in CDCl3

¹H NMR	399.65 MHz
C₇ H₇ Br O	0.040 g : 0.5 ml CDCl₃
o-bromobenzyl alcohol

    Assign.     Shift(ppm)

      A             7.527
      B             7.453
      C             7.310
      D             7.146
      E             4.713
      F             2.41

     Hz     ppm     Int.

   3012.94   7.539    541
   3011.72   7.536    560
   3009.16   7.530     42
   3008.54   7.528     41
   3005.00   7.520    596
   3003.78   7.517    617
   2983.89   7.467    355
   2983.52   7.466    343
   2982.79   7.464    332
   2982.06   7.462    370
   2976.20   7.448    454
   2975.83   7.447    425
   2975.22   7.445    411
   2974.49   7.443    466
   2929.57   7.331    315
   2928.34   7.328    312
   2925.90   7.322     41
   2922.24   7.312    560
   2921.02   7.309    554
   2917.97   7.302     33
   2916.99   7.299     33
   2914.55   7.293    302
   2913.33   7.290    280
   2864.26   7.167    305
   2862.55   7.163    292
   2856.81   7.149    430
   2856.32   7.148    416
   2855.10   7.145    426
   2848.88   7.129    220
   2847.17   7.125    212
   1886.60   4.721   1000
   1880.49   4.706    993
    969.97   2.428    278
    963.87   2.412    634
    957.52   2.396    259

¹H NMR	89.56 MHz
C₇ H₇ Br O	saturated in CDCl₃
o-bromobenzyl alcohol

    Assign.     Shift(ppm)

      A             7.52
      B             7.43
      C             7.28
      D             7.15
      E             4.742
      F             2.06

     Hz     ppm     Int.

    680.25   7.596    123
    679.00   7.582    113
    678.25   7.574    110
    675.44   7.542     66
    674.88   7.536     73
    672.81   7.513    315
    671.25   7.495    214
    668.63   7.466     92
    668.00   7.459    166
    667.44   7.453    171
    666.75   7.445    107
    665.69   7.433    201
    665.19   7.428    179
    663.75   7.412    126
    662.19   7.394    135
    656.63   7.332    238
    655.06   7.315    171
    649.50   7.253    224
    648.00   7.236    210
    645.69   7.210    140
    640.88   7.156    122
    640.50   7.152    118
    638.38   7.128    111
    633.31   7.072     45
    631.19   7.048     38
    424.75   4.743   1000
    184.25   2.058    451

in CDCl3

KBr disc

nujol mull

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