2451-62-9

1,3,5-三缩水甘油-S-三嗪三酮(2451-62-9)红外图谱(IR1)

产品名称:1,3,5-三缩水甘油-S-三嗪三酮

CAS:2451-62-9

分子式:C12H15N3O6

分子量: 297.26

InChI:InChI=1S/C12H15N3O6/c16-10-13(1-7-4-19-7)11(17)15(3-9-6-21-9)12(18)14(10)2-8-5-20-8/h7-9H,1-6H2

InChIKey: OUPZKGBUJRBPGC-UHFFFAOYSA-N

Smiles:N1(CC2CO2)C(=O)N(CC2CO2)C(=O)N(CC2CO2)C1=O

IR1

IR2

Raman

Mass

MS-IW-1820          
1,3,5-tris(oxiranylmethyl)-1,3,5-triazine-2,4,6(1H,3H,5H)-trione
C12H15N3O6          (Mass of molecular ion:    297)

   Source Temperature: 170 °C
   Sample Temperature: 160 °C
   Direct, 75 eV

      15.0       5.0
      18.0       2.1
      26.0       1.8
      27.0      18.0
      28.0      18.0
      29.0      19.0
      30.0       5.1
      31.0      24.5
      39.0       2.1
      40.0       7.2
      41.0      17.6
      42.0      18.8
      43.0      15.5
      44.0       9.8
      45.0       1.6
      54.0       5.8
      55.0      13.0
      56.0     100.0
      57.0      26.4
      58.0       5.3
      67.0       1.4
      68.0       6.9
      69.0      18.2
      70.0      73.6
      71.0       8.0
      72.0       4.8
      81.0       1.4
      82.0      68.7
      83.0      17.5
      84.0      10.6
      85.0       3.2
      86.0      11.0
      87.0       7.7
      95.0       2.3
      96.0       3.8
      97.0       4.0
      98.0      22.7
      99.0      55.9
     100.0      13.7
     101.0       1.6
     109.0       1.3
     110.0       2.5
     111.0       9.5
     112.0       6.6
     113.0      14.2
     114.0       1.9
     121.0       1.2
     123.0       2.4
     124.0       4.9
     125.0      15.4
     126.0       4.5
     127.0       5.0
     129.0       2.1
     130.0       5.4
     137.0       1.1
     138.0       1.2
     139.0       4.6
     140.0       1.3
     141.0       4.5
     142.0       3.1
     143.0      31.3
     144.0       2.7
     153.0       2.0
     154.0       3.6
     155.0       4.2
     156.0      11.3
     157.0       2.0
     167.0       1.4
     168.0       2.4
     169.0       7.1
     170.0       3.3
     171.0       1.9
     180.0       1.2
     181.0       2.2
     182.0       2.4
     183.0       2.3
     184.0       2.7
     185.0       2.9
     186.0       2.5
     194.0       1.7
     195.0       1.6
     196.0       1.7
     197.0       1.2
     198.0       3.1
     199.0       6.6
     207.0       1.1
     208.0       1.2
     209.0       2.2
     210.0       2.7
     211.0       2.6
     212.0       4.8
     213.0       1.4
     223.0       1.3
     224.0       3.7
     225.0       4.6
     226.0       5.0
     236.0       1.5
     237.0      11.8
     238.0       5.1
     239.0      10.5
     240.0       2.2
     241.0       1.1
     242.0       3.0
     250.0       3.2
     251.0       1.5
     254.0       8.4
     255.0      73.5
     256.0       9.2
     257.0       1.3
     266.0       7.7
     267.0      32.3
     268.0      11.1
     269.0       3.9
     280.0       1.0
     296.0       1.5
     297.0      15.7
     298.0       2.5

KBr disc