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120-50-3

苯甲酸异丁酯(120-50-3)红外图谱(IR2)

产品名称:苯甲酸异丁酯

CAS:120-50-3

分子式:C11H14O2

分子量: 178.23

InChI:InChI=1S/C11H14O2/c1-9(2)8-13-11(12)10-6-4-3-5-7-10/h3-7,9H,8H2,1-2H3

InChIKey: KYZHGEFMXZOSJN-UHFFFAOYSA-N

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

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    Mass

    MS-NW-0931          
    isobutyl benzoate
    C11H14O2            (Mass of molecular ion:    178)
    

       Source Temperature: 280 °C
       Sample Temperature: 150 °C
       Reservoir, 75 eV
    

          18.0       1.2
          27.0       3.2
          28.0       3.0
          29.0       4.1
          39.0       3.6
          41.0       7.6
          43.0       1.6
          50.0       3.6
          51.0      12.5
          55.0       1.3
          56.0      27.5
          57.0       2.3
          73.0       1.1
          76.0       2.1
          77.0      35.7
          78.0       2.9
          79.0       2.4
         105.0     100.0
         106.0       8.3
         122.0       2.0
         123.0      40.9
         124.0       3.3
    

in CDCl3

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CCl4 solution

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liquid film

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4880 A,200 M,liquid

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