Welcome to chemicalbook!
+1 (818) 612-2111
Inquriy
Try our best to find the right business for you.
Do not miss inquiry messages Please log in to view all inquiry messages.

Welcome back!

Back ChemicalBook Home>CAS DataBase List>620-17-7More Spectrum> 3-Ethylphenol(620-17-7) IR1

3-Ethylphenol(620-17-7) IR1

Product Name3-Ethylphenol

CAS620-17-7

Molecular FormulaC8H10O

Molecular Weight122.16

InChIInChI=1S/C8H10O/c1-2-7-4-3-5-8(9)6-7/h3-6,9H,2H2,1H3

InChIKey HMNKTRSOROOSPP-UHFFFAOYSA-N

SmilesC1(O)=CC=CC(CC)=C1


  • Mass

    MS-NW-8681          
    m-ethylphenol
    C8H10O              (Mass of molecular ion:    122)
    

       Source Temperature: 250 °C
       Sample Temperature: 140 °C
       Reservoir, 75 eV
    

          27.0       3.0
          38.0       1.4
          39.0       7.3
          41.0       1.5
          50.0       1.7
          51.0       4.4
          52.0       1.7
          53.0       3.2
          55.0       1.9
          59.0       1.1
          60.0       1.6
          62.0       1.0
          63.0       2.6
          65.0       3.7
          66.0       1.4
          77.0      18.6
          78.0       3.4
          79.0       6.6
          91.0       4.9
          93.0       1.7
          94.0       5.8
          95.0       1.0
         103.0       3.3
         105.0       1.2
         107.0     100.0
         108.0       7.8
         121.0       5.2
         122.0      45.8
         123.0       4.1
    

400 MHz in CDCl3


  • 1H NMR 399.65 MHz
    C8 H10 O 20.0 mg : 0.5 ml CDCl3
    m-ethylphenol
    ChemicalStructure
        Assign.     Shift(ppm)
    A 7.146 B 6.779 C 6.683 D 6.652 E 5.07 F 2.595 G 1.211

         Hz     ppm     Int.
    

       2863.77   7.166     83
       2856.20   7.147    168
       2848.39   7.128     98
       2714.72   6.793     31
       2714.11   6.792     60
       2713.13   6.789     89
       2712.52   6.788     90
       2711.67   6.786     68
       2710.94   6.784     34
       2706.54   6.773     55
       2705.57   6.770     81
       2704.96   6.769     82
       2704.10   6.767     61
       2673.34   6.690     65
       2672.73   6.688     74
       2672.24   6.687     63
       2671.75   6.686     77
       2671.14   6.684    106
       2670.65   6.683    126
       2670.17   6.682    111
       2669.19   6.679    103
       2668.58   6.678     92
       2663.70   6.666     78
       2663.21   6.664     77
       2662.84   6.663     79
       2661.13   6.659     51
       2660.64   6.658     47
       2660.16   6.657     46
       2655.76   6.646     69
       2655.27   6.644     67
       2654.79   6.643     69
       2653.20   6.639     52
       2652.71   6.638     48
       2652.22   6.637     49
       2026.25   5.071    417
       1048.58   2.624     63
       1041.02   2.605    190
       1033.45   2.586    194
       1025.76   2.567     67
        491.70   1.231    499
        484.13   1.212   1000
        476.44   1.193    485
    

in CDCl3



CCl4 solution



liquid film



3-Ethylphenol(620-17-7) IR1 Atlas of Related Products

×