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返回ChemicalBook首页>CAS数据库列表>15231-78-4更多图谱> 2,2-二甲基-5-苯基-1,3-二氧杂环乙烷-4,6-二酮(15231-78-4)红外图谱(IR2)

15231-78-4

2,2-二甲基-5-苯基-1,3-二氧杂环乙烷-4,6-二酮(15231-78-4)红外图谱(IR2)

分子式:C12H12O4

分子量: 220.22

InChI:InChI=1S/C12H12O4/c1-12(2)15-10(13)9(11(14)16-12)8-6-4-3-5-7-8/h3-7,9H,1-2H3

InChIKey: NTUAHNQWHPQAMB-UHFFFAOYSA-N

Smiles:O1C(=O)C(C2=CC=CC=C2)C(=O)OC1(C)C

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    Mass

    MS-IW-0864          
    2,2-dimethyl-5-phenyl-1,3-dioxane-4,6-dione
    C12H12O4            (Mass of molecular ion:    220)
    

       Source Temperature: 140 °C
       Sample Temperature:  90 °C
       Direct, 75 eV
    

          15.0       3.5
          17.0       1.1
          18.0       6.3
          27.0       1.3
          28.0       2.3
          38.0       1.6
          39.0       5.4
          40.0       1.2
          42.0       1.5
          43.0      49.8
          44.0      21.1
          45.0       2.0
          50.0       1.6
          51.0       3.4
          58.0      12.6
          59.0       2.6
          62.0       3.0
          63.0       9.7
          64.0       3.9
          65.0       2.3
          77.0       2.2
          89.0      33.0
          90.0      53.1
          91.0      18.8
          92.0       3.1
         105.0       4.0
         107.0       1.1
         118.0     100.0
         119.0       9.0
         133.0       1.7
         136.0       5.7
         145.0       7.7
         162.0       5.9
         205.0       1.9
         220.0       7.2
    

KBr disc

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nujol mull

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