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601-79-6

异丙基丙二酸(601-79-6)核磁图(13CNMR)

产品名称:异丙基丙二酸

CAS:601-79-6

分子式:C6H10O4

分子量: 146.14

InChI:InChI=1S/C6H10O4/c1-3(2)4(5(7)8)6(9)10/h3-4H,1-2H3,(H,7,8)(H,9,10)

InChIKey: DQEUFPARIOFOAI-UHFFFAOYSA-N

Smiles:C(O)(=O)C(C(C)C)C(O)=O

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    Mass

    MS2015-05152CW      
    isopropylmalonic acid
    C6H10O4             (Mass of molecular ion:    146)
    

       Source Temperature: 250 °C
       Sample Temperature:  20 °C
       Direct, 70 eV
    

          18.0       2.6
          27.0       8.4
          28.0       7.5
          29.0       6.0
          31.0       1.4
          32.0       1.8
          38.0       1.8
          39.0      16.5
          40.0       2.5
          41.0      24.4
          42.0       6.7
          43.0      15.3
          44.0       7.2
          45.0       7.5
          53.0       2.2
          55.0       6.0
          56.0       2.0
          57.0       2.5
          59.0       3.9
          60.0      10.6
          68.0       2.4
          69.0      20.9
          82.0       5.4
          83.0       6.3
          84.0       4.5
          85.0       9.7
          86.0      66.0
          87.0      29.8
          88.0       1.4
         100.0      12.7
         101.0       4.8
         102.0       2.2
         104.0     100.0
         105.0       5.6
         113.0       2.2
         129.0       1.6
    

in DMSO-d6

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in DMSO-d6

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KBr disc

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nujol mull

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