4-tert-Butylaniline(769-92-6) IR1

Product Name4-tert-Butylaniline

CAS 769-92-6

Molecular FormulaC10H15N

Molecular Weight149.23

InChIInChI=1S/C10H15N/c1-10(2,3)8-4-6-9(11)7-5-8/h4-7H,11H2,1-3H3

InChIKey WRDWWAVNELMWAM-UHFFFAOYSA-N

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

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Mass

MS-IW-9541          
p-tert-butylaniline
C10H15N             (Mass of molecular ion:    149)

   Source Temperature: 220 °C
   Sample Temperature: 150 °C
   Reservoir, 75 eV

      27.0       1.4
      28.0       1.9
      29.0       1.1
      39.0       4.3
      41.0       5.1
      51.0       1.9
      52.0       1.4
      53.0       1.4
      58.5       2.2
      63.0       1.5
      65.0       5.2
      65.5       2.1
      66.0       3.0
      67.0       1.9
      77.0       5.0
      78.0       1.4
      79.0       1.3
      89.0       1.0
      91.0       4.9
      92.0       1.3
      93.0       9.5
      94.0      15.6
      95.0       1.1
     105.0       1.0
     106.0      16.1
     107.0       1.6
     115.0       1.3
     117.0       3.5
     118.0       5.6
     119.0       6.1
     120.0       1.0
     132.0       1.6
     133.0       2.3
     134.0     100.0
     135.0      10.3
     149.0      22.7
     150.0       2.7

400 MHz in CDCl3

¹H NMR	399.65 MHz
C₁₀ H₁₅ N	0.05 ml : 0.5 ml CDCl₃
p-tert-butylaniline

    Assign.     Shift(ppm)

      A             7.164
      B             6.598
      C             3.50
      D             1.266

     Hz     ppm     Int.

   2870.24   7.182     34
   2867.43   7.175    197
   2865.23   7.170     73
   2860.96   7.159     81
   2858.76   7.154    199
   2855.96   7.147     28
   2643.92   6.616     38
   2641.11   6.609    215
   2638.92   6.604     75
   2634.52   6.593     78
   2632.57   6.588    190
   2629.52   6.580     26
   1396.97   3.496     44
    519.53   1.300     24
    506.10   1.267   1000
      0.00   0.001     73

in CDCl3