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16225-26-6

3,5-二叔丁基苯甲酸(16225-26-6)红外图谱(IR2)

分子式:C15H22O2

分子量: 234.33

InChI:InChI=1S/C15H22O2/c1-14(2,3)11-7-10(13(16)17)8-12(9-11)15(4,5)6/h7-9H,1-6H3,(H,16,17)

InChIKey: NCTSLPBQVXUAHR-UHFFFAOYSA-N

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

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    Mass

    MS-KW-0795          
    3,5-di-tert-butylbenzoic acid
    C15H22O2            (Mass of molecular ion:    234)
    

       Source Temperature: 130 °C
       Sample Temperature: 110 °C
       Direct, 75 eV
    

          18.0       1.2
          29.0       3.8
          39.0       1.4
          41.0       8.0
          55.0       1.4
          57.0      26.5
          58.0       1.3
          64.0       1.3
          77.0       1.5
          78.0       2.8
          79.0       2.4
          87.0       2.2
          88.0       3.9
          91.0       4.6
         101.5       1.9
         102.0       4.5
         105.0       1.4
         115.0       1.8
         117.0       1.5
         119.0       1.5
         128.0       1.2
         129.0       1.0
         131.0       1.1
         145.0       1.2
         163.0       2.3
         191.0       6.0
         203.0       1.0
         219.0     100.0
         220.0      15.5
         221.0       1.5
         234.0      12.6
         235.0       2.1
    

in CDCl3

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in CDCl3

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KBr disk

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Nujol

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