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theophyllin, compound with 2-aminoethanol
SpectraBase Compound ID Do2BuM11nuI
InChI InChI=1S/C7H8N4O2.C2H7NO/c1-10-5-4(8-3-9-5)6(12)11(2)7(10)13;3-1-2-4/h3H,1-2H3,(H,8,9);4H,1-3H2
InChIKey DAAFJZUNCOXSKD-UHFFFAOYSA-N
Mol Weight 241.25 g/mol
Molecular Formula C9H15N5O3
Exact Mass 241.117489 g/mol
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Source of Sample Eli Lilly & Company, Lilly Research Labs., Inc., Indianapolis, Indiana
Solvent D2O

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