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CAS RN 83-67-0

H3CNNNCH3ONHO

CAS RN 83-67-0

IUPAC Name: 3,7-dimethyl-2,3,6,7-tetrahydro-1H-purine-2,6-dione
Synonyms: theobromine 可可碱
Molecular Weight (g/mol): 180.17
Molecular Formula: C7H8N4O2
InChi Key: YAPQBXQYLJRXSA-UHFFFAOYSA-N
SMILES: CN1C=NC2=C1C(=O)NC(=O)N2C
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