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HEXYL 4-HYDROXYBENZOATE

Product Name HEXYL 4-HYDROXYBENZOATE

CAS1083-27-8

MFC13H18O3

MW222.28

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  • Mass

    MS-NW-0288          
    hexyl p-hydroxybenzoate
    C13H18O3            (Mass of molecular ion:    222)
    

       Source Temperature: 170 °C
       Sample Temperature:   0 °C
       Direct, 75 eV
    

          18.0       1.7
          27.0       2.6
          28.0       1.3
          29.0       3.0
          39.0       6.4
          41.0       5.6
          42.0       2.4
          43.0       5.3
          55.0       5.1
          56.0       5.7
          57.0       1.1
          63.0       1.7
          64.0       1.3
          65.0       9.7
          69.0       2.6
          84.0       1.7
          92.0       1.6
          93.0       9.7
          95.0       1.4
         120.0       1.2
         121.0      66.7
         122.0       6.0
         138.0     100.0
         139.0      29.7
         140.0       2.6
         222.0       7.7
         223.0       1.2
    

90 MHz in DMSO-d6


  • 1H NMR 89.56 MHz
    C13 H18 O3 0.038 g : 0.5 ml DMSO-d6
    hexyl p-hydroxybenzoate
    ChemicalStructure
        Assign.     Shift(ppm)
    A 10. B 7.82 C 6.86 D 4.197 E 1.68 F 1.49 to 1.15 G 0.87

         Hz     ppm     Int.
    

        707.98   7.906     77
        705.29   7.876    783
        703.21   7.852    285
        698.44   7.799    267
        696.36   7.776   1000
        693.74   7.747    145
        621.70   6.942     98
        619.02   6.912    954
        616.87   6.888    457
        614.79   6.865     99
        612.24   6.837    224
        610.09   6.813    796
        608.01   6.789    219
        382.76   4.274    259
        379.60   4.239     75
        376.58   4.205    684
        370.20   4.134    364
        150.12   1.677    193
        115.48   1.290    738
         83.39   0.932    254
         80.23   0.896    237
         77.81   0.869    828
         71.91   0.803    182
         71.44   0.798    177
         68.35   0.764     80
    

DMSO-d6



KBr disc



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