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2,4,6(3H)-Pteridinetrione, 1,4a,5,8a-tetrahydro-7-methyl-
SpectraBase Compound ID 5q6pSn4A5mv
InChI InChI=1S/C7H6N4O3/c1-2-5(12)9-3-4(8-2)10-7(14)11-6(3)13/h3H,1H3,(H,9,12)(H,11,13,14)
InChIKey PZGXNGZKGYATDW-UHFFFAOYSA-N
Mol Weight 194.15 g/mol
Molecular Formula C7H6N4O3
Exact Mass 194.04399 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID GyJ8WwjDGRb
Name 2,4,6(3H)-Pteridinetrione, 1,4a,5,8a-tetrahydro-7-methyl-
CAS Registry Number 14868-37-2
Comments Structure changed after expert review
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C7H6N4O3
InChI InChI=1S/C7H6N4O3/c1-2-5(12)9-3-4(8-2)10-7(14)11-6(3)13/h3H,1H3,(H,9,12)(H,11,13,14)
InChIKey PZGXNGZKGYATDW-UHFFFAOYSA-N
Molecular Weight 194.150 g/mol
SMILES N1C(N=C2C(C1=O)NC(C(=N2)C)=O)=O
SPLASH splash10-002f-9800000000-d4f985224a87afe2c2b3
Source of Spectrum T-66-277-0
Synonyms 7-Methyl-2,4,6-pteridinetriol
Wiley ID 21547