75359-31-8

邻苯二甲酸双十三酯(75359-31-8)质谱(MS)

分子式:C34H58O4

分子量: 530.82

InChI:InChI=1S/C34H58O4/c1-3-5-7-9-11-13-15-17-19-21-25-29-37-33(35)31-27-23-24-28-32(31)34(36)38-30-26-22-20-18-16-14-12-10-8-6-4-2/h23-24,27-28H,3-22,25-26,29-30H2,1-2H3

InChIKey: YCZJVRCZIPDYHH-UHFFFAOYSA-N

Smiles:C(OCCCCCCCCCCCCC)(=O)C1=CC=CC=C1C(OCCCCCCCCCCCCC)=O

IR1

IR2

IR3

Mass

MS-NW-1591          
ditridecyl phthalate
C34H58O4            (Mass of molecular ion:    530)

   Source Temperature: 260 °C
   Sample Temperature: 170 °C
   Direct, 75 eV

      27.0       2.3
      29.0       7.8
      39.0       2.1
      41.0      22.3
      42.0       5.0
      43.0      47.2
      44.0       1.5
      50.0       1.1
      53.0       1.4
      54.0       1.5
      55.0      38.1
      56.0      12.2
      57.0      74.0
      58.0       3.2
      67.0       4.2
      68.0       3.1
      69.0      39.8
      70.0      16.2
      71.0      54.5
      72.0       3.2
      76.0       3.2
      77.0       1.3
      81.0       4.4
      82.0       3.9
      83.0      25.2
      84.0      12.0
      85.0      41.7
      86.0       2.7
      93.0       1.0
      95.0       3.4
      96.0       3.4
      97.0      18.6
      98.0       7.9
      99.0      25.2
     100.0       2.0
     104.0       4.3
     105.0       1.9
     109.0       1.7
     110.0       1.9
     111.0      10.8
     112.0       5.2
     113.0      21.0
     114.0       2.0
     121.0       1.0
     123.0       1.1
     124.0       1.3
     125.0       6.5
     126.0       3.3
     127.0      12.4
     128.0       1.2
     139.0       3.3
     140.0       1.8
     141.0       2.4
     149.0     100.0
     150.0      11.4
     151.0       1.5
     153.0       1.8
     154.0       2.8
     167.0      27.2
     168.0       2.5
     169.0       1.9
     176.0       1.0
     182.0       4.0
     183.0      10.5
     184.0       1.6
     307.0       1.5
     331.0       1.7
     332.0       2.3
     335.0       5.2
     336.0       1.2
     349.0      45.0
     350.0      10.5
     351.0       1.5
     363.0       2.9

CCl4 solution