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Substance Name: 2,3,6,9-Tetrahydro-1,3,7,9-tetramethyl-2,6-dioxo-1H-purinium methyl sulphate
RN: 18623-34-2
InChIKey: CODOGAUIMIDHBR-UHFFFAOYSA-M

Molecular Formula

  • C9-H13-N4-O2.C-H3-O4-S

Molecular Weight

  • 320.3244
 
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Names and Synonyms

Synonym

  • EINECS 242-454-4

Systematic Name

  • 2,3,6,9-Tetrahydro-1,3,7,9-tetramethyl-2,6-dioxo-1H-purinium methyl sulphate

Registry Numbers

CAS Registry Number

  • 18623-34-2

System Generated Number

  • 0018623342

Molecular Formulas

Molecular Formula

  • C9-H13-N4-O2.C-H3-O4-S

Molecular Formula Fragments

  • C-H3-O4-S
  • C9-H13-N4-O2
  • COMPONENT

Structure Descriptors

InChI

1S/C9H13N4O2.CH4O4S/c1-10-5-11(2)7-6(10)8(14)13(4)9(15)12(7)3;1-5-6(2,3)4/h5H,1-4H3;1H3,(H,2,3,4)/q+1;/p-1

InChIKey

CODOGAUIMIDHBR-UHFFFAOYSA-M

Smiles

Cn1c[n+](c2c1n(c(=O)n(c2=O)C)C)C.COS(=O)(=O)[O-]