2944-52-7

2,6-DIISOPROPYLANISOLE(2944-52-7) IR1

Product Name2,6-DIISOPROPYLANISOLE

CAS 2944-52-7

Molecular FormulaC13H20O

Molecular Weight192.3

InChIInChI=1S/C13H20O/c1-9(2)11-7-6-8-12(10(3)4)13(11)14-5/h6-10H,1-5H3

InChIKey NJIYPCPZILAPKS-UHFFFAOYSA-N

SmilesC1(C(C)C)=CC=CC(C(C)C)=C1OC

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¹HNMR

¹³CNMR

IR1

2,6-DIISOPROPYLANISOLE(2944-52-7) IR1
Mass

MS-IW-3503          
2,6-diisopropylanisole
C13H20O             (Mass of molecular ion:    192)

   Source Temperature: 220 °C
   Sample Temperature: 160 °C
   Reservoir, 75 eV

      27.0       2.0
      29.0       1.0
      39.0       3.3
      41.0       8.1
      43.0       5.6
      51.0       2.3
      53.0       1.8
      55.0       1.1
      63.0       1.5
      65.0       2.9
      67.0       1.4
      73.0       1.8
      77.0       5.5
      78.0       1.6
      79.0       3.5
      80.0       1.2
      81.0       5.3
      91.0      18.3
      92.0       1.6
     103.0       2.9
     104.0       1.0
     105.0       9.0
     107.0       1.8
     115.0       6.3
     116.0       2.3
     117.0       9.3
     118.0       1.3
     119.0      28.9
     120.0       3.2
     121.0       2.7
     127.0       1.5
     128.0       4.4
     129.0       2.6
     130.0       1.5
     131.0       2.3
     133.0       3.2
     135.0       3.1
     145.0       6.1
     146.0       1.0
     147.0       5.9
     149.0      14.8
     150.0       1.8
     161.0       2.9
     162.0       4.7
     163.0       1.2
     177.0     100.0
     178.0      13.3
     179.0       1.0
     192.0      40.5
     193.0       5.9

400 MHz in CDCl3

2,6-DIISOPROPYLANISOLE(2944-52-7) IR1

¹H NMR	399.65 MHz
C₁₃ H₂₀ O	0.05 ml : 0.5 ml CDCl₃
2,6-diisopropylanisole

    Assign.     Shift(ppm)

      A          7.11 to 7.06
      B             3.726
      C             3.342
      D             1.234

     Hz     ppm     Int.

   2843.99   7.117     40
   2838.38   7.103     89
   2834.23   7.092    392
   2832.40   7.088    246
   2828.61   7.078     83
   2822.51   7.063     25
   1489.26   3.727    797
   1349.85   3.378     45
   1342.90   3.361    113
   1335.94   3.343    149
   1329.10   3.326    117
   1322.14   3.309     50
    506.84   1.269     28
    496.83   1.244   1000
    489.87   1.226    952
    482.91   1.209     64
    479.86   1.201     35

in CDCl3

liquid film

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