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(8-Imidazol-1-yl-1,3-dimethyl-2,6-dioxo-1,2,3,6-tetrahydro-purin-7-yl)-acetic acid ethyl ester
SpectraBase Compound ID 6ppzCOFJuzl
InChI InChI=1S/C14H16N6O4/c1-4-24-9(21)7-20-10-11(16-13(20)19-6-5-15-8-19)17(2)14(23)18(3)12(10)22/h5-6,8H,4,7H2,1-3H3
InChIKey PLYYNMDCTDGKNN-UHFFFAOYSA-N
Mol Weight 332.32 g/mol
Molecular Formula C14H16N6O4
Exact Mass 332.123303 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID DDNYl1lPVYe
Name (8-Imidazol-1-yl-1,3-dimethyl-2,6-dioxo-1,2,3,6-tetrahydro-purin-7-yl)-acetic acid ethyl ester
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Formula C14H16N6O4
InChI InChI=1S/C14H16N6O4/c1-4-24-9(21)7-20-10-11(16-13(20)19-6-5-15-8-19)17(2)14(23)18(3)12(10)22/h5-6,8H,4,7H2,1-3H3
InChIKey PLYYNMDCTDGKNN-UHFFFAOYSA-N
Molecular Weight 332.320 g/mol
SMILES c12c([n](CC(=O)OCC)c(n2)-[n]2cncc2)C(=O)N(C(N1C)=O)C
SPLASH splash10-001i-9674000000-defff3cfad9775e9b1af
Synonyms 2-(8-imidazol-1-yl-2,6-diketo-1,3-dimethyl-purin-7-yl)acetic acid ethyl ester 2-[8-(1-imidazolyl)-1,3-dimethyl-2,6-dioxo-7-purinyl]acetic acid ethyl ester Ethyl 2-(8-imidazol-1-yl-1,3-dimethyl-2,6-dioxo-purin-7-yl)acetate Ethyl 2-[8-imidazol-1-yl-1,3-dimethyl-2,6-bis(oxidanylidene)purin-7-yl]ethanoate
Wiley ID 1462111