
CAS 84718-95-6
:Formula:C7H8N4O2
InChI:InChI=1S/C7H8N4O2/c1-10-5-4(8-3-9-5)6(12)11(2)7(10)13/h3H,1-2H3,(H,8,9)/i7+1,10+1,11+1
InChI key:ZFXYFBGIUFBOJW-NBLDSOAPSA-N
SMILES:C[15N]1C2=C(C(=O)[15N]([13C]1=O)C)NC=N2
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Theophylline-1,3-15N2-2-13C
CAS:Controlled ProductFormula:C6CH8N2N2O2Color and Shape:NeatMolecular weight:183.14
