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3,7-Dimethyl-1-prop-2-ynyl-9H-purine-2,6,8-trione
SpectraBase Compound ID JVywghvsvs1
InChI InChI=1S/C10H10N4O3/c1-4-5-14-8(15)6-7(13(3)10(14)17)11-9(16)12(6)2/h1H,5H2,2-3H3,(H,11,16)
InChIKey AWYBZGBLOSVVHX-UHFFFAOYSA-N
Mol Weight 234.21 g/mol
Molecular Formula C10H10N4O3
Exact Mass 234.07529 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID LAIdfSynYqu
Name 3,7-Dimethyl-1-prop-2-ynyl-9H-purine-2,6,8-trione
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C10H10N4O3
InChI InChI=1S/C10H10N4O3/c1-4-5-14-8(15)6-7(13(3)10(14)17)11-9(16)12(6)2/h1H,5H2,2-3H3,(H,11,16)
InChIKey AWYBZGBLOSVVHX-UHFFFAOYSA-N
Molecular Weight 234.215 g/mol
SMILES N1C(N(C2=C1N(C(N(C2=O)CC#C)=O)C)C)=O
SPLASH splash10-001i-9150000000-346d575ff6df3eff9045
Source of Spectrum KC-0-679-34
Synonyms 3,7-Dimethyl-1-propargyl-9H-purine-2,6,8-trione
Wiley ID 827716