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102-16-9

苯乙酸苯甲酯(102-16-9)质谱(MS)

产品名称:苯乙酸苯甲酯

CAS:102-16-9

分子式:C15H14O2

分子量: 226.27

InChI:InChI=1S/C15H14O2/c16-15(11-13-7-3-1-4-8-13)17-12-14-9-5-2-6-10-14/h1-10H,11-12H2

InChIKey: MIYFJEKZLFWKLZ-UHFFFAOYSA-N

Smiles:C1(CC(OCC2=CC=CC=C2)=O)=CC=CC=C1

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    Mass

    MS-NW-8490          
    benzyl phenylacetate
    C15H14O2            (Mass of molecular ion:    226)
    

       Source Temperature: 260 °C
       Sample Temperature: 140 °C
       Reservoir, 75 eV
    

          39.0       3.9
          41.0       1.3
          51.0       2.5
          63.0       2.0
          65.0      10.0
          77.0       2.2
          79.0       1.0
          89.0       2.2
          90.0       1.8
          91.0     100.0
          92.0       9.2
         108.0       3.0
         226.0       2.4
    

90 MHz in CDCl3

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    1H NMR 89.56 MHz
    C15 H14 O2 0.04 ml : 0.5 ml CDCl3
    benzyl phenylacetate
    ChemicalStructure
        Assign.     Shift(ppm)
    A 7.31 B 7.28 C 5.124 D 3.658

         Hz     ppm     Int.
    

        654.69   7.311   1000
        653.56   7.298    260
        652.31   7.284    830
        649.06   7.248     45
        648.25   7.239     29
        458.94   5.125    342
        327.69   3.659    360
    

in CDCl3

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liquid film

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4880 A,200 M,liquid

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