2961-47-9

4-(1-丁戊基)吡啶(2961-47-9)红外图谱(IR1)

产品名称:4-(1-丁戊基)吡啶

CAS:2961-47-9

分子式:C14H23N

分子量: 205.34

InChI:InChI=1S/C14H23N/c1-3-5-7-13(8-6-4-2)14-9-11-15-12-10-14/h9-13H,3-8H2,1-2H3

InChIKey: ATCGHKBXRIOBDX-UHFFFAOYSA-N

Smiles:C1=NC=CC(C(CCCC)CCCC)=C1

¹HNMR

¹³CNMR

IR1

Mass

MS-NW-6637          
4-(1-butylpentyl)pyridine
C14H23N             (Mass of molecular ion:    205)

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

      18.0       1.9
      27.0      10.7
      29.0      15.1
      39.0       8.5
      40.0       1.0
      41.0      18.6
      42.0       1.4
      43.0      10.8
      50.0       1.3
      51.0       5.7
      52.0       4.0
      53.0       2.9
      54.0       1.7
      55.0       4.7
      56.0       1.3
      57.0       7.1
      63.0       1.7
      65.0      10.1
      66.0       1.3
      67.0       1.1
      69.0       1.2
      77.0       6.6
      78.0       6.0
      79.0       4.4
      80.0       3.3
      81.0       1.1
      91.0       4.5
      92.0      30.3
      93.0      30.6
      94.0       3.9
      95.0       1.2
     104.0       4.1
     105.0      12.2
     106.0      91.5
     107.0      12.9
     108.0       1.4
     117.0       5.2
     118.0      11.2
     119.0       8.8
     120.0      11.0
     121.0       6.8
     122.0       2.1
     130.0       1.6
     132.0       4.1
     133.0       5.6
     134.0       4.8
     135.0       1.0
     146.0       1.6
     147.0       2.9
     148.0     100.0
     149.0      90.8
     150.0      10.7
     162.0      15.1
     163.0       5.7
     176.0       2.4
     190.0       1.5
     204.0       1.8
     205.0      40.9
     206.0       7.1

90 MHz in CDCl3

¹H NMR	89.56 MHz
C₁₄ H₂₃ N	0.05 ml : 0.5 ml CDCl₃
4-(1-butylpentyl)pyridine

    Assign.     Shift(ppm)

      A             8.482
      B             7.063
      C             2.41
      D             1.58
      E             1.20
      F             0.83

     Hz     ppm     Int.

    763.06   8.521    361
    761.44   8.503    236
    758.63   8.471    248
    757.00   8.453    392
    635.56   7.097    388
    634.00   7.080    252
    631.06   7.047    238
    629.50   7.029    354
    221.81   2.477     74
    143.69   1.605    245
    138.63   1.548    247
    138.06   1.542    249
    107.06   1.196    479
    104.19   1.164    429
    100.38   1.121    414
     80.00   0.894    494
     73.94   0.826   1000
     67.56   0.755    253

in CDCl3