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Back ChemicalBook Home>CAS DataBase List>5182-44-5More Spectrum> 3-CHLOROPHENETHYLALCOHOL(5182-44-5) IR1

5182-44-5

3-CHLOROPHENETHYLALCOHOL(5182-44-5) IR1

Molecular FormulaC8H9ClO

Molecular Weight156.61

InChIInChI=1S/C8H9ClO/c9-8-3-1-2-7(6-8)4-5-10/h1-3,6,10H,4-5H2

InChIKey NDWAVJKRSASRPH-UHFFFAOYSA-N

SmilesC1(CCO)=CC=CC(Cl)=C1

  • 3-CHLOROPHENETHYLALCOHOL(5182-44-5) IR1
    Mass

    MS-NW-6441          
    m-chlorophenethyl alcohol
    C8H9ClO             (Mass of molecular ion:    156)
    

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

          18.0       1.1
          27.0       1.5
          29.0       1.8
          31.0      16.7
          38.0       1.7
          39.0       6.8
          41.0       1.0
          43.0       1.3
          50.0       4.3
          51.0       6.1
          61.0       1.2
          62.0       2.8
          63.0       8.7
          64.0       2.1
          65.0       5.2
          73.0       2.6
          74.0       1.8
          75.0       3.9
          76.0       1.0
          77.0       4.8
          89.0      16.0
          90.0       7.2
          91.0     100.0
          92.0       7.9
          99.0       5.5
         101.0       2.6
         102.0       1.8
         103.0       3.8
         112.0       4.6
         114.0       1.5
         125.0      62.7
         126.0      46.3
         127.0      24.3
         128.0      15.4
         129.0       1.2
         137.0       1.0
         138.0       3.9
         139.0       1.0
         140.0       1.4
         156.0      41.1
         157.0       4.0
         158.0      13.9
         159.0       1.4
    

400 MHz in CDCl3

  • 3-CHLOROPHENETHYLALCOHOL(5182-44-5) IR1

    1H NMR 399.65 MHz
    C8 H9 Cl O 0.05 ml : 0.5 ml CDCl3
    m-chlorophenethyl alcohol
    ChemicalStructure
        Assign.     Shift(ppm)
    A 7.21 to 7.19 B 7.078 C 3.768 D 2.784 E 2.34

         Hz     ppm     Int.
    

       2890.75   7.234    103
       2890.01   7.232    111
       2884.16   7.217    129
       2882.93   7.214    322
       2882.20   7.212    373
       2879.76   7.206    265
       2878.42   7.203    505
       2877.93   7.202    519
       2875.98   7.197   1000
       2874.15   7.192    622
       2872.80   7.189    352
       2868.41   7.178    146
       2866.33   7.173    136
       2833.74   7.091    188
       2832.03   7.087    271
       2829.10   7.079    101
       2827.15   7.075    151
       2826.42   7.073    126
       2825.20   7.070    202
       2824.71   7.068    174
       2823.97   7.067    132
       2823.49   7.065    146
       1515.26   3.792    124
       1509.03   3.776    250
       1505.00   3.766    258
       1498.66   3.750    141
       1119.26   2.801    419
       1112.67   2.785    768
       1105.96   2.768    399
        934.69   2.339    196
    

in CDCl3

  • 3-CHLOROPHENETHYLALCOHOL(5182-44-5) IR1

liquid film

  • 3-CHLOROPHENETHYLALCOHOL(5182-44-5) IR1

4880 A,200 M,liquid

  • 3-CHLOROPHENETHYLALCOHOL(5182-44-5) IR1

3-CHLOROPHENETHYLALCOHOL(5182-44-5) IR1 Atlas of Related Products

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