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2-(3-Methyl-2-methylsulfanyl-4,6-dioxo-5,7-dihydropyrrolo[2,3-d]pyrimidin-5-yl)acetic acid
SpectraBase Compound ID 9RqljbNb6y6
InChI InChI=1S/C10H11N3O4S/c1-13-9(17)6-4(3-5(14)15)8(16)11-7(6)12-10(13)18-2/h4H,3H2,1-2H3,(H,11,16)(H,14,15)
InChIKey UVONPZDJMLMBOO-UHFFFAOYSA-N
Mol Weight 269.27 g/mol
Molecular Formula C10H11N3O4S
Exact Mass 269.047027 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 6RA45LuI8M6
Name 2-(3-Methyl-2-methylsulfanyl-4,6-dioxo-5,7-dihydropyrrolo[2,3-d]pyrimidin-5-yl)acetic acid
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C10H11N3O4S
InChI InChI=1S/C10H11N3O4S/c1-13-9(17)6-4(3-5(14)15)8(16)11-7(6)12-10(13)18-2/h4H,3H2,1-2H3,(H,11,16)(H,14,15)
InChIKey UVONPZDJMLMBOO-UHFFFAOYSA-N
Molecular Weight 269.275 g/mol
SMILES N1C(C(CC(=O)O)C2=C1N=C(N(C2=O)C)SC)=O
SPLASH splash10-001l-5290000000-e1b11208806b7b4d0090
Source of Spectrum F-54-5759-3
Synonyms 2-[3-methyl-2-(methylthio)-4,6-dioxo-5,7-dihydropyrrolo[2,3-d]pyrimidin-5-yl]acetic acid 2-[3-methyl-2-methylsulfanyl-4,6-bis(oxidanylidene)-5,7-dihydropyrrolo[2,3-d]pyrimidin-5-yl]ethanoic acid 2-[4,6-diketo-3-methyl-2-(methylthio)-5,7-dihydropyrrolo[2,3-d]pyrimidin-5-yl]acetic acid
Wiley ID 807171