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2-[(1',3'-Dimethyl-2',4'-dioxopurin-8'-yl)hydrazono]-2-(2"-thienyl)acetic acid
SpectraBase Compound ID LIagdS8iY9d
InChI InChI=1S/C13H12N6O4S/c1-18-9-8(10(20)19(2)13(18)23)14-12(15-9)17-16-7(11(21)22)6-4-3-5-24-6/h3-5H,1-2H3,(H,21,22)(H2,14,15,17)/b16-7-
InChIKey XAHNJPYGHQJGDM-APSNUPSMSA-N
Mol Weight 348.34 g/mol
Molecular Formula C13H12N6O4S
Exact Mass 348.064074 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 1IDdQkiQLSn
Name 2-[(1',3'-Dimethyl-2',4'-dioxopurin-8'-yl)hydrazono]-2-(2"-thienyl)acetic acid
Alternate Name(s) 2-[(1',3'-Dimethyl-2',4'-dioxopurin-8'-yl)hydrazono]-2-(2''-thienyl)acetic acid (2E)-2-[(1,3-dimethyl-2,6-dioxo-7H-purin-8-yl)hydrazinylidene]-2-thiophen-2-ylacetic acid (2E)-2-[(1,3-dimethyl-2,6-dioxo-7H-purin-8-yl)hydrazono]-2-(2-thienyl)acetic acid (2E)-2-[[1,3-dimethyl-2,6-bis(oxidanylidene)-7H-purin-8-yl]hydrazinylidene]-2-thiophen-2-yl-ethanoic acid
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Formula C13H12N6O4S
InChI InChI=1S/C13H12N6O4S/c1-18-9-8(10(20)19(2)13(18)23)14-12(15-9)17-16-7(11(21)22)6-4-3-5-24-6/h3-5H,1-2H3,(H,21,22)(H2,14,15,17)/b16-7-
InChIKey XAHNJPYGHQJGDM-APSNUPSMSA-N
Molecular Weight 348.337 g/mol
SMILES [nH]1c(nc2c1C(=O)N(C(N2C)=O)C)N\N=C/(C(=O)O)c1sccc1
SPLASH splash10-001i-9201000000-cf6c50955973a60abb2c
Source of Spectrum Y-38-609-9
Wiley ID 848360