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CAS 58-08-2: Caffeine

Formula:C8H10N4O2
InChI:InChI=1S/C8H10N4O2/c1-10-4-9-6-5(10)7(13)12(3)8(14)11(6)2/h4H,1-3H3
InChI key:InChIKey=RYYVLZVUVIJVGH-UHFFFAOYSA-N
SMILES:O=C1C2=C(N(C)C(=O)N1C)N=CN2C
Synonyms:
  • 1,3,7-Trimethyl-2,3,6,7-tetrahydro-1H-purine-2,6-dione
  • 1,3,7-Trimethyl-2,6-Dioxopurine
  • 1,3,7-Trimethyl-3,7-dihydro-purine-2,6-dione
  • 1,3,7-Trimethyl-7H-purine-2,6-dione
  • 1,3,7-Trimethylxanthine
  • 1H-Purine-2,6-dione, 3,7-dihydro-1,3,7-trimethyl-
  • 3,7-Dihydro-1,3,7-trimethyl-1H-purine-2,6-dione
  • 3,7-Dihydro-1,3,7-trimethyl-1H-purine-2,6-dione~1,3,7-Trimethylxanthine
  • 7-Methyltheophylline
  • Alert-Pep
  • Asia migrine
  • See more synonyms
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