589-16-2

4-乙基苯胺(589-16-2)質(zhì)譜(MS)

產(chǎn)品名稱(chēng):4-乙基苯胺

CAS:589-16-2

分子式:C8H11N

分子量: 121.18

InChI:InChI=1S/C8H11N/c1-2-7-3-5-8(9)6-4-7/h3-6H,2,9H2,1H3

InChIKey: HRXZRAXKKNUKRF-UHFFFAOYSA-N

Smiles:C1(N)=CC=C(CC)C=C1

Mass

MS-NW-0449          
p-ethylaniline
C8H11N              (Mass of molecular ion:    121)

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

      27.0       1.2
      28.0       1.6
      39.0       3.2
      41.0       1.4
      50.0       1.0
      51.0       2.3
      52.0       2.1
      53.0       3.0
      54.0       1.1
      58.5       1.0
      63.0       1.6
      65.0       3.1
      66.0       1.4
      77.0       7.6
      78.0       2.6
      79.0       3.0
      80.0       1.3
      91.0       2.7
      92.0       1.1
      93.0       2.5
     103.0       1.2
     104.0       1.5
     106.0     100.0
     107.0       8.3
     118.0       1.9
     119.0       2.0
     120.0       5.6
     121.0      37.8
     122.0       3.3

90 MHz in CDCl3

¹H NMR	89.56 MHz
C₈ H₁₁ N	0.05 ml : 0.5 ml CDCl₃
p-ethylaniline

    Assign.     Shift(ppm)

      A             6.96
      B             6.579
      C             3.40
      D             2.514
      E             1.173

     Hz     ppm     Int.

    630.63   7.042     55
    628.19   7.015    286
    626.00   6.990    115
    621.81   6.943    160
    619.63   6.919    419
    617.75   6.898     74
    617.25   6.893     76
    594.81   6.642     96
    592.44   6.616    523
    590.31   6.592    158
    588.63   6.573     45
    587.94   6.565     45
    586.06   6.544    140
    584.06   6.522    310
    581.44   6.493     46
    304.75   3.403    119
    237.25   2.650     83
    229.63   2.564    263
    226.31   2.527     37
    226.00   2.524     37
    222.06   2.480    297
    218.06   2.435     31
    217.06   2.424     32
    214.81   2.399    119
    112.13   1.253    486
    110.38   1.233     58
    109.94   1.228     56
    104.75   1.170   1000
    102.75   1.148     87
    100.75   1.125     50
    100.19   1.119     49
     97.00   1.084    363

in CDCl3