Hexahydro-1,3,5-tris(2,3-dibromopropyl)-1,3,5-triazine-2,4,6-trione(52434-90-9) MS
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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MassMS-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
KBr disc
nujol mull
4880 A,200 M,powder
