622-08-2

2-苄氧基乙醇(622-08-2)质谱(MS)

产品名称:2-苄氧基乙醇

CAS:622-08-2

分子式:C9H12O2

分子量: 152.19

InChI:InChI=1S/C9H12O2/c10-6-7-11-8-9-4-2-1-3-5-9/h1-5,10H,6-8H2

InChIKey: CUZKCNWZBXLAJX-UHFFFAOYSA-N

Smiles:C(O)COCC1=CC=CC=C1

Mass

MS-NW-6069          
2-(benzyloxy)ethanol
C9H12O2             (Mass of molecular ion:    152)

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

      27.0       2.3
      28.0       1.6
      29.0       2.0
      31.0       3.7
      39.0       5.4
      41.0       1.5
      43.0       1.2
      45.0       5.0
      50.0       1.5
      51.0       4.1
      52.0       1.2
      63.0       2.4
      65.0      10.5
      77.0       4.5
      78.0       1.3
      79.0       6.2
      89.0       2.9
      90.0       1.9
      91.0     100.0
      92.0      24.5
      93.0       1.6
     105.0       2.4
     106.0       1.5
     107.0      23.4
     108.0       2.4
     151.0       1.5
     152.0      14.4
     153.0       1.5

400 MHz in CDCl3

¹H NMR	399.65 MHz
C₉ H₁₂ O₂	0.05 ml : 0.5 ml CDCl₃
2-(benzyloxy)ethanol

    Assign.     Shift(ppm)

      A             7.32
      B             7.270
      C             4.508
      D             3.682
      E             3.527
      F             3.12

     Hz     ppm     Int.

   2935.30   7.345     31
   2934.33   7.343     34
   2932.50   7.338     35
   2929.20   7.330    135
   2926.51   7.323    661
   2922.00   7.312   1000
   2917.85   7.302     87
   2914.79   7.294     42
   2913.33   7.290     75
   2909.30   7.280    123
   2906.01   7.272    118
   2904.54   7.268    119
   2900.63   7.258    121
   2897.83   7.251     55
   2895.75   7.246     67
   2892.09   7.237     30
   1801.64   4.509    882
   1476.56   3.695    299
   1474.49   3.690     92
   1472.17   3.684    371
   1470.83   3.681    212
   1468.87   3.676    107
   1467.29   3.672    385
   1413.70   3.538    384
   1411.99   3.534     97
   1410.03   3.529    240
   1408.94   3.526    374
   1406.37   3.520     87
   1404.42   3.515    290
   1245.36   3.117    504

in CDCl3