104-63-2

N-芐基乙醇胺(104-63-2)質(zhì)譜(MS)

產(chǎn)品名稱:N-芐基乙醇胺

CAS:104-63-2

分子式:C9H13NO

分子量: 151.21

InChI:InChI=1S/C9H13NO/c11-7-6-10-8-9-4-2-1-3-5-9/h1-5,10-11H,6-8H2

InChIKey: XNIOWJUQPMKCIJ-UHFFFAOYSA-N

Smiles:C(O)CNCC1=CC=CC=C1

Mass

MS-NW-9043          
2-(benzylamino)ethanol
C9H13NO             (Mass of molecular ion:    151)

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

      17.0       2.7
      18.0      13.3
      27.0       1.0
      28.0       2.2
      30.0       2.5
      39.0       2.9
      41.0       1.2
      42.0       2.0
      45.0       1.0
      51.0       2.4
      56.0       1.3
      60.0       1.0
      63.0       1.8
      65.0       8.1
      74.0       1.1
      77.0       2.4
      79.0       2.2
      89.0       1.9
      90.0       1.1
      91.0     100.0
      92.0       9.8
     105.0       1.0
     106.0       2.6
     107.0       1.0
     118.0       2.0
     120.0      45.4
     121.0       4.2
     151.0       1.1

90 MHz in CDCl3

¹H NMR	89.56 MHz
C₉ H₁₃ N O	0.04 ml : 0.5 ml CDCl₃
2-(benzylamino)ethanol

    Assign.     Shift(ppm)

      A          7.38 to 7.17
      B             3.772
      C             3.62
      D             2.75
      E             2.55

     Hz     ppm     Int.

    655.81   7.323     46
    654.63   7.310    135
    652.75   7.289   1000
    651.19   7.271    241
    649.50   7.253     82
    649.13   7.248     95
    337.81   3.772    595
    329.63   3.681    135
    326.56   3.647     40
    324.63   3.625    175
    323.31   3.610    107
    322.00   3.596     52
    319.31   3.566    191
    251.56   2.809    190
    248.81   2.779     48
    247.50   2.764     99
    246.25   2.750    171
    244.31   2.728     50
    241.25   2.694    145
    228.69   2.554    291

in CDCl3