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Back ChemicalBook Home>CAS DataBase List>5437-25-2More Spectrum> 2,6-Dithiopurine(5437-25-2) IR1

2,6-Dithiopurine(5437-25-2) IR1

Product Name2,6-Dithiopurine

CAS5437-25-2

Molecular FormulaC5H4N4S2

Molecular Weight184.24

InChIInChI=1S/C5H4N4S2/c10-4-2-3(7-1-6-2)8-5(11)9-4/h1H,(H3,6,7,8,9,10,11)

InChIKey VQPMXSMUUILNFZ-UHFFFAOYSA-N

SmilesN1C2=C(NC(=S)NC2=S)NC=1


  • Mass

    MS-IW-9447          
    2,6-purinedithiol
    C5H4N4S2            (Mass of molecular ion:    184)
    

       Source Temperature: 180 °C
       Sample Temperature: 250 °C
       Direct, 75 eV
    

          18.0       3.7
          26.0       2.5
          27.0      18.5
          28.0      33.0
          32.0       6.9
          33.0       3.8
          34.0       8.4
          38.0       4.1
          39.0       2.4
          40.0       1.2
          43.0       1.6
          44.0      10.9
          45.0       9.9
          46.0       1.4
          52.0       1.3
          53.0       8.4
          54.0       6.7
          55.0       1.2
          56.0       1.1
          57.0       1.6
          58.0       1.8
          59.0       5.0
          60.0       4.8
          64.0       3.7
          65.0       2.1
          66.0       3.9
          67.0       1.5
          68.0       1.0
          70.0      16.3
          71.0      23.5
          72.0       5.2
          73.0       1.9
          76.0       5.9
          80.0       2.4
          81.0       4.9
          82.0       2.0
          83.0       3.7
          84.0       3.7
          85.0       4.9
          91.0       1.6
          92.0       5.6
          93.0       3.1
          96.0       1.1
          97.0       7.4
          98.0      11.2
          99.0       3.8
         102.0       7.8
         103.0       1.8
         108.0       3.0
         109.0       2.0
         118.0       1.8
         123.0       4.3
         124.0       5.7
         125.0      16.7
         126.0      38.2
         127.0       3.1
         128.0       1.8
         129.0       1.2
         150.0       9.4
         151.0      34.2
         152.0       3.9
         153.0       1.6
         156.0       4.3
         157.0       1.4
         167.0       1.3
         168.0       1.9
         183.0       2.0
         184.0     100.0
         185.0       9.0
         186.0       9.8
    

KBr disc



nujol mull



2,6-Dithiopurine(5437-25-2) IR1 Atlas of Related Products

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