1003-03-8

環(huán)戊胺(1003-03-8)質(zhì)譜(MS)

產(chǎn)品名稱:環(huán)戊胺

CAS:1003-03-8

分子式:C5H11N

分子量: 85.15

InChI:InChI=1S/C5H11N/c6-5-3-1-2-4-5/h5H,1-4,6H2

InChIKey: NISGSNTVMOOSJQ-UHFFFAOYSA-N

Smiles:C1(N)CCCC1

Mass

MS-NW-4935          
cyclopentylamine
C5H11N              (Mass of molecular ion:     85)

   Source Temperature: 260 °C
   Sample Temperature: 180 °C
   Reservoir, 75 eV

      15.0       1.5
      18.0       1.4
      27.0       2.9
      28.0       9.1
      29.0       3.2
      30.0      15.5
      39.0       3.9
      41.0       5.4
      42.0       6.2
      43.0      11.0
      54.0       1.2
      56.0     100.0
      57.0      17.4
      67.0       2.5
      68.0       1.1
      70.0       1.1
      84.0       2.0
      85.0       9.3

400 MHz in CDCl3

¹H NMR	399.65 MHz
C₅ H₁₁ N	0.04 ml : 0.5 ml CDCl₃
cyclopentylamine

    Assign.     Shift(ppm)

      A             3.314
      B     *1      1.820
      C     *2      1.715
      D     *1      1.547
      E             1.37
      F     *2      1.277

     Hz     ppm     Int.

   1338.62   3.350    200
   1332.64   3.335    675
   1326.05   3.319   1000
   1319.95   3.303    703
   1319.58   3.302    674
   1313.48   3.287    226
    745.61   1.866    159
    744.02   1.862    152
    740.36   1.853    212
    739.01   1.850    345
    737.43   1.846    380
    735.60   1.841    260
    731.81   1.832    527
    729.37   1.826    269
    726.56   1.818    537
    725.46   1.816    542
    724.85   1.814    528
    722.78   1.809    292
    720.58   1.804    489
    719.24   1.800    481
    716.43   1.793    154
    715.94   1.792    155
    715.21   1.790    175
    713.99   1.787    279
    713.26   1.785    245
    712.52   1.783    284
    706.42   1.768    163
    696.29   1.743    238
    693.36   1.735    409
    691.16   1.730    345
    690.55   1.728    335
    689.45   1.726    507
    688.96   1.724    502
    687.99   1.722    553
    685.55   1.716    609
    684.33   1.713    555
    683.11   1.710    463
    682.50   1.708    451
    680.18   1.702    448
    678.10   1.697    499
    675.42   1.691    288
    672.73   1.684    205
    666.87   1.669    173
    633.42   1.585    176
    630.00   1.577    221
    629.39   1.575    204
    628.78   1.574    214
    626.95   1.569    452
    625.61   1.566    470
    624.76   1.564    394
    623.41   1.560    330
    622.07   1.557    468
    621.09   1.555    601
    619.38   1.550    681
    618.41   1.548    642
    617.19   1.545    383
    614.50   1.538    646
    613.40   1.535    524
    611.94   1.532    341
    610.47   1.528    392
    609.38   1.525    323
    608.40   1.523    221
    607.30   1.520    237
    606.08   1.517    248
    550.90   1.379    968
    526.49   1.318    278
    525.39   1.315    177
    524.90   1.314    196
    520.51   1.303    457
    518.92   1.299    440
    517.70   1.296    414
    513.79   1.286    543
    512.94   1.284    555
    511.72   1.281    535
    509.64   1.276    250
    509.03   1.274    275
    507.69   1.271    533
    507.32   1.270    535
    506.59   1.268    504
    506.10   1.267    503
    505.00   1.264    437
    503.05   1.259    240
    501.10   1.254    386
    498.90   1.249    373
    495.12   1.239    152
    492.80   1.234    158

in CDCl3