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4-己氧基苯甲酸(1142-39-8)质谱(MS)

产品名称:4-己氧基苯甲酸

CAS:1142-39-8

分子式:C13H18O3

分子量: 222.28

InChI:InChI=1S/C13H18O3/c1-2-3-4-5-10-16-12-8-6-11(7-9-12)13(14)15/h6-9H,2-5,10H2,1H3,(H,14,15)

InChIKey: HBQUXMZZODHFMJ-UHFFFAOYSA-N

Smiles:C(O)(=O)C1=CC=C(OCCCCCC)C=C1


  • Mass

    MS2003-01615WA      
    p-hexyloxybenzoic acid
    C13H18O3            (Mass of molecular ion:    222)
    

       Source Temperature: 250 °C
       Sample Temperature: 270 °C
       Reservoir, 70 eV
    

          27.0       3.0
          29.0       4.1
          39.0       3.9
          41.0       9.1
          42.0       2.8
          43.0      23.5
          44.0       1.1
          51.0       1.1
          53.0       1.4
          55.0       7.3
          56.0       4.1
          57.0       3.1
          63.0       1.4
          64.0       1.0
          65.0       7.1
          69.0       3.5
          76.0       1.3
          77.0       1.3
          81.0       2.1
          84.0       4.5
          85.0       2.6
          92.0       1.0
          93.0       2.8
          95.0       1.7
         121.0      28.1
         122.0       2.3
         138.0     100.0
         139.0      22.9
         140.0       2.1
         151.0       2.4
         222.0      25.3
         223.0       3.7
    

KBr disc



nujol mull



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