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111-14-8

庚酸(111-14-8)Raman光谱

产品名称:庚酸

CAS:111-14-8

分子式:C7H14O2

分子量: 130.18

InChI:InChI=1S/C7H14O2/c1-2-3-4-5-6-7(8)9/h2-6H2,1H3,(H,8,9)

InChIKey: MNWFXJYAOYHMED-UHFFFAOYSA-N

Smiles:C(O)(=O)CCCCCC

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    Mass

    MS-NW-0544          
    heptanoic acid
    C7H14O2             (Mass of molecular ion:    130)
    

       Source Temperature: 260 °C
       Sample Temperature: 180 °C
       Reservoir, 75 eV
    

          18.0       2.2
          26.0       1.1
          27.0      15.1
          28.0       3.9
          29.0      15.8
          31.0       1.6
          39.0       8.2
          40.0       1.4
          41.0      24.2
          42.0       6.1
          43.0      27.1
          45.0       5.7
          53.0       1.3
          55.0      15.9
          56.0       3.8
          57.0       2.4
          59.0       3.0
          60.0     100.0
          61.0      11.7
          68.0       2.8
          69.0       4.3
          70.0      12.6
          71.0      14.1
          73.0      47.1
          74.0       5.6
          83.0       2.8
          84.0       4.4
          87.0      19.6
          88.0       1.3
         101.0       6.1
    

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in CDCl3

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liquid film

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4880 A,150M,liquid

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