4-N-OCTYLANILINE(16245-79-7) IR1

Product Name4-N-OCTYLANILINE

CAS 16245-79-7

Molecular FormulaC14H23N

Molecular Weight205.34

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

InChIKey ORKQJTBYQZITLA-UHFFFAOYSA-N

SmilesC1(N)=CC=C(CCCCCCCC)C=C1

Request For Quotation

Mass

MS-NW-7330          
p-octylaniline
C14H23N             (Mass of molecular ion:    205)

   Source Temperature: 210 °C
   Sample Temperature: 190 °C
   Reservoir, 75 eV

      29.0       1.1
      41.0       1.6
      77.0       2.7
      78.0       1.3
      79.0       1.4
      92.0       1.0
      93.0       1.0
     106.0     100.0
     107.0       8.3
     119.0       1.6
     120.0       1.2
     205.0      14.0
     206.0       2.2

400 MHz in CDCl3

¹H NMR	399.65 MHz
C₁₄ H₂₃ N	0.05 ml : 0.5 ml CDCl₃
p-octylaniline

    Assign.     Shift(ppm)

      A             6.944
      B             6.579
      C             3.43
      D             2.480
      E             1.542
      F          1.34 to 1.23
      G             0.876

     Hz     ppm     Int.

   2782.23   6.962     73
   2779.54   6.955    497
   2777.59   6.951    224
   2773.19   6.940    193
   2771.12   6.934    599
   2768.68   6.928    107
   2634.89   6.593    106
   2632.32   6.587    696
   2630.25   6.582    268
   2625.98   6.571    222
   2623.90   6.566    659
   2621.34   6.560     93
   1371.34   3.432    709
    996.70   2.494    298
    989.14   2.476    367
    981.20   2.456    321
    630.25   1.578     46
    622.92   1.559    133
    615.60   1.541    182
    607.91   1.522    140
    600.71   1.504     51
    523.07   1.309    236
    515.14   1.289    604
    510.86   1.279    683
    509.89   1.276    689
    501.59   1.256    687
    355.83   0.891    331
    349.12   0.874   1000
    342.04   0.856    413

in CDCl3