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1-But-3-enyl-3,7-dimethyl-9H-purine-2,6,8-trione
SpectraBase Compound ID CRhjOyPtJcT
InChI InChI=1S/C11H14N4O3/c1-4-5-6-15-9(16)7-8(14(3)11(15)18)12-10(17)13(7)2/h4H,1,5-6H2,2-3H3,(H,12,17)
InChIKey ZDLNDPWGSKCSNW-UHFFFAOYSA-N
Mol Weight 250.26 g/mol
Molecular Formula C11H14N4O3
Exact Mass 250.10659 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID JEDjVxgbBHq
Name 1-But-3-enyl-3,7-dimethyl-9H-purine-2,6,8-trione
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C11H14N4O3
InChI InChI=1S/C11H14N4O3/c1-4-5-6-15-9(16)7-8(14(3)11(15)18)12-10(17)13(7)2/h4H,1,5-6H2,2-3H3,(H,12,17)
InChIKey ZDLNDPWGSKCSNW-UHFFFAOYSA-N
Molecular Weight 250.258 g/mol
SMILES N1C(N(C2=C1N(C(N(C2=O)CCC=C)=O)C)C)=O
SPLASH splash10-0f7k-3920000000-11de6d6cf7f6f1a58f46
Source of Spectrum KC-0-679-35
Wiley ID 827715