52434-90-9

Hexahydro-1,3,5-tris(2,3-dibromopropyl)-1,3,5-triazine-2,4,6-trione(52434-90-9) MS

Product NameHexahydro-1,3,5-tris(2,3-dibromopropyl)-1,3,5-triazine-2,4,6-trione

CAS 52434-90-9

Molecular FormulaC12H15Br6N3O3

Molecular Weight728.69

InChIInChI=1S/C12H15Br6N3O3/c13-1-7(16)4-19-10(22)20(5-8(17)2-14)12(24)21(11(19)23)6-9(18)3-15/h7-9H,1-6H2

InChIKey NZUPFZNVGSWLQC-UHFFFAOYSA-N

SmilesN1(CC(Br)CBr)C(=O)N(CC(Br)CBr)C(=O)N(CC(Br)CBr)C1=O

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Hexahydro-1,3,5-tris(2,3-dibromopropyl)-1,3,5-triazine-2,4,6-trione(52434-90-9) MS
Mass

MS-NW-9273          
tris(2,3-dibromopropyl) isocyanurate
C12H15Br6N3O3       (Mass of molecular ion:    723)

   Source Temperature: 210 °C
   Sample Temperature: 170 °C
   Direct, 75 eV

      17.0       2.2
      18.0      11.0
      27.0       4.9
      28.0      13.2
      29.0       1.2
      39.0      19.3
      40.0       2.1
      41.0      44.9
      42.0       3.2
      43.0       1.9
      44.0       1.9
      45.0       2.1
      53.0       1.0
      54.0      12.2
      55.0       7.5
      56.0     100.0
      57.0       4.4
      58.0       3.5
      68.0       2.5
      69.0       4.4
      70.0      34.6
      71.0       5.7
      79.0       4.7
      80.0      13.9
      81.0       4.5
      82.0      90.2
      83.0      41.2
      84.0      18.8
      85.0       1.1
      87.0       1.2
      93.0       2.3
      95.0       2.3
      96.0       4.8
      97.0       1.1
      99.0       3.6
     107.0       1.3
     111.0       1.2
     119.0      15.6
     121.0      15.1
     124.0       1.8
     125.0      13.2
     126.0       1.7
     127.0       2.3
     134.0       1.1
     136.0       1.3
     137.0       1.8
     139.0      10.7
     158.0       1.4
     160.0       3.2
     162.0      16.5
     164.0      14.4
     165.0       1.6
     168.0       8.4
     170.0       1.3
     180.0       1.5
     182.0       1.0
     199.0       3.9
     201.0       7.1
     203.0       3.6
     205.0       2.2
     207.0       2.1
     208.0      11.1
     209.0       1.9
     222.0       4.7
     234.0       1.7
     246.0       1.1
     248.0      12.6
     249.0      22.1
     250.0       6.3
     260.0       6.9
     262.0       6.7
     286.0       3.5
     288.0       8.1
     289.0       1.1
     290.0       4.9
     299.0       1.2
     300.0       1.8
     302.0       1.8
     326.0       1.5
     328.0      14.9
     329.0       2.3
     330.0      13.3
     331.0       1.9
     340.0       2.2
     342.0       4.1
     344.0       2.0
     366.0       4.1
     368.0       7.6
     370.0       3.8
     380.0       1.6
     382.0       2.5
     384.0       1.1
     406.0       1.7
     407.0       4.0
     408.0       3.6
     409.0       7.8
     410.0       2.6
     411.0       3.9
     446.0       1.7
     448.0       4.0
     450.0       3.7
     452.0       1.1
     460.0       1.0
     486.0       3.4
     488.0       9.0
     489.0       1.3
     490.0       8.5
     491.0       1.3
     492.0       2.9
     540.0       1.5
     542.0       2.0
     544.0       1.3
     566.0       1.6
     567.0       1.3
     568.0       2.3
     569.0       1.9
     570.0       1.7
     571.0       1.2
     644.0       1.5
     646.0       7.4
     647.0       1.1
     648.0      14.0
     649.0       2.0
     650.0      13.8
     651.0       2.0
     652.0       6.8
     654.0       1.4

in CDCl3