1-氨基戊烷(110-58-7)質(zhì)譜(MS)

產(chǎn)品名稱:1-氨基戊烷

CAS:110-58-7

分子式:C5H13N

分子量: 87.16

InChI:InChI=1S/C5H13N/c1-2-3-4-5-6/h2-6H2,1H3

InChIKey: DPBLXKKOBLCELK-UHFFFAOYSA-N

Smiles:C(N)CCCC

Mass

MS-NW-3726          
pentylamine
C5H13N              (Mass of molecular ion:     87)

   Source Temperature: 280 °C
   Sample Temperature: 180 °C
   Reservoir, 75 eV

      18.0       2.4
      27.0       3.1
      28.0       2.8
      29.0       2.0
      30.0     100.0
      31.0       1.9
      39.0       1.8
      41.0       3.1
      42.0       2.3
      43.0       1.4
      44.0       1.6
      45.0       3.3
      87.0       4.5

90 MHz in CDCl3

¹H NMR	89.56 MHz
C₅ H₁₃ N	0.05 ml : 0.5 ml CDCl₃
pentylamine

    Assign.     Shift(ppm)

      A             2.68
      B          1.68 to 1.02
      C             1.12
      D             0.91

     Hz     ppm     Int.

    246.69   2.755    137
    245.19   2.738    122
    240.00   2.680    390
    233.50   2.608    229
    143.19   1.599     40
    138.25   1.544     43
    136.63   1.526    107
    135.94   1.518    116
    133.25   1.488     91
    130.88   1.462    169
    128.88   1.440    258
    125.13   1.398    298
    122.06   1.363    608
    121.63   1.359    599
    120.44   1.345    734
    119.69   1.337    676
    118.81   1.327    676
    115.94   1.295    445
    113.00   1.262    206
    112.25   1.254    201
    110.88   1.239    181
    109.94   1.228    166
    109.25   1.220    163
    108.38   1.211    156
    107.06   1.196    123
    100.38   1.121    468
     88.13   0.985    184
     86.38   0.965    292
     85.44   0.954    249
     83.06   0.928    232
     80.81   0.903   1000
     76.69   0.857    114
     74.81   0.836    177
     74.00   0.827    172
     70.81   0.791     62

in CDCl3