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6402-36-4

反式-2-十二碳烯二酸(6402-36-4)质谱(MS)

分子式:C12H20O4

分子量: 228.28

InChI:InChI=1S/C12H20O4/c13-11(14)9-7-5-3-1-2-4-6-8-10-12(15)16/h7,9H,1-6,8,10H2,(H,13,14)(H,15,16)/b9-7+

InChIKey: MAZWDMBCPDUFDJ-VQHVLOKHSA-N

Smiles:C(O)(=O)/C=C/CCCCCCCCC(O)=O

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    Mass

    MS-NW-2064          
    trans-2-dodecenedioic acid
    C12H20O4            (Mass of molecular ion:    228)
    

       Source Temperature: 180 °C
       Sample Temperature: 220 °C
       Direct, 75 eV
    

          14.0       1.5
          15.0       2.9
          16.0       1.4
          17.0       7.9
          18.0      41.7
          26.0       7.9
          27.0      41.1
          28.0      17.5
          29.0      41.1
          30.0       1.1
          31.0       4.7
          37.0       1.3
          38.0       2.8
          39.0      43.1
          40.0      10.3
          41.0      82.9
          42.0      14.7
          43.0      30.4
          44.0      16.3
          45.0      13.0
          50.0       2.9
          51.0       6.1
          52.0       3.9
          53.0      22.9
          54.0      30.3
          55.0     100.0
          56.0      13.4
          57.0      12.0
          58.0       3.0
          59.0       7.1
          60.0      22.6
          61.0       1.5
          63.0       1.6
          65.0       6.0
          66.0       8.6
          67.0      45.1
          68.0      46.8
          69.0      35.0
          70.0       9.3
          71.0       8.8
          72.0       1.5
          73.0      25.8
          74.0       2.7
          77.0       7.0
          78.0       6.6
          79.0      22.8
          80.0      17.4
          81.0      68.1
          82.0      36.2
          83.0      26.0
          84.0      28.4
          85.0       5.3
          86.0      18.8
          87.0       6.9
          88.0       1.4
          91.0      14.3
          92.0       6.3
          93.0      12.5
          94.0      16.6
          95.0      28.6
          96.0      33.4
          97.0      20.9
          98.0      37.3
          99.0      11.4
         100.0      12.2
         101.0       6.0
         103.0       1.4
         104.0       4.3
         105.0       5.9
         106.0       7.4
         107.0       9.3
         108.0      11.1
         109.0      15.6
         110.0      10.5
         111.0       5.9
         112.0       4.9
         113.0       4.9
         114.0       9.1
         115.0       3.8
         116.0       1.3
         117.0       5.0
         118.0       3.1
         119.0       4.6
         120.0       6.0
         121.0       6.9
         122.0      16.2
         123.0      12.4
         124.0      10.2
         125.0       5.2
         126.0       2.9
         127.0       3.5
         128.0       3.5
         129.0       2.2
         130.0       6.3
         131.0       3.0
         132.0       4.2
         133.0       4.8
         134.0       1.2
         135.0       5.6
         136.0       8.1
         137.0       8.4
         138.0       8.2
         139.0       2.2
         140.0       2.0
         141.0       1.3
         142.0       1.2
         143.0       1.1
         145.0       1.5
         146.0       3.5
         147.0       2.9
         148.0       2.7
         149.0       3.7
         150.0       8.3
         151.0       6.3
         152.0       1.0
         153.0       1.7
         154.0       1.6
         156.0       1.1
         163.0       1.8
         164.0      12.8
         165.0       2.6
         166.0       5.5
         167.0       2.0
         168.0       3.8
         174.0       3.0
         175.0       1.3
         182.0      17.1
         183.0       2.5
         192.0      19.4
         193.0       2.5
         210.0       9.8
         211.0       1.9
    

KBr disc

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nujol mull

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