2,5-Dihydroxy-1,4-dioxane-2,5-dimethanol(62147-49-3) IR1

Product Name2,5-Dihydroxy-1,4-dioxane-2,5-dimethanol

CAS 62147-49-3

Molecular FormulaC6H12O6

Molecular Weight180.16

InChIInChI=1/C6H12O6/c7-1-5(9)3-12-6(10,2-8)4-11-5/h7-10H,1-4H2/t5-,6+

InChIKey KEQUNHIAUQQPAC-OLQVQODUNA-N

SmilesO1C[C@](O)(CO)OC[C@@]1(O)CO |&1:2,8,r|

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IR1

IR2

Mass

MS-NW-4780          
1,3-dihydroxyacetone dimer
C6H12O6             (Mass of molecular ion:    180)

   Source Temperature: 220 °C
   Sample Temperature: 150 °C
   Direct, 75 eV

      14.0       2.7
      15.0      10.3
      17.0       7.5
      18.0      35.8
      19.0       2.3
      26.0       1.6
      27.0       2.4
      28.0       5.7
      29.0      20.7
      30.0       4.6
      31.0     100.0
      32.0       9.0
      33.0      12.7
      40.0       1.1
      41.0       1.2
      42.0      14.7
      43.0      30.6
      44.0       2.6
      45.0       3.8
      46.0       1.5
      55.0       1.9
      56.0       2.6
      57.0       3.5
      59.0       2.2
      60.0       7.0
      61.0       4.5
      62.0       4.2
      72.0       9.7
      73.0       5.6
      74.0       2.8
      85.0       2.3
      86.0       1.1
      87.0       1.1
      88.0       1.2
      91.0       1.0
     101.0       1.1
     103.0       1.5
     114.0       1.0
     115.0       2.0
     127.0       2.0
     131.0       3.1
     145.0       1.0

KBr disc