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1,3-dimethyl-2,6-dioxo-1,2,3,6-tetrahydropurine-7-carboxylic acid, ethyl ester
SpectraBase Compound ID Ej07mk3vThV
InChI InChI=1S/C10H12N4O4/c1-4-18-10(17)14-5-11-7-6(14)8(15)13(3)9(16)12(7)2/h5H,4H2,1-3H3
InChIKey QSIIYGLZPGMUMS-UHFFFAOYSA-N
Mol Weight 252.23 g/mol
Molecular Formula C10H12N4O4
Exact Mass 252.085855 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID LNjUCXaMQeI
Name 1,3-Dimethyl-2,6-dioxo-7-purinecarboxylic acid ethyl ester
CAS Registry Number 101774-91-8
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C10H12N4O4
InChI InChI=1S/C10H12N4O4/c1-4-18-10(17)14-5-11-7-6(14)8(15)13(3)9(16)12(7)2/h5H,4H2,1-3H3
InChIKey QSIIYGLZPGMUMS-UHFFFAOYSA-N
Molecular Weight 252.230 g/mol
SMILES c12c(N(C)C(N(C2=O)C)=O)nc[n]1C(=O)OCC
SPLASH splash10-001i-0920000000-1aacd5cb416583fb69e6
Source of Spectrum K-124-344-22
Synonyms 2,6-Diketo-1,3-dimethyl-purine-7-carboxylic acid ethyl ester Ethyl 1,3-dimethyl-2,6-bis(oxidanylidene)purine-7-carboxylate Ethyl 1,3-dimethyl-2,6-dioxo-purine-7-carboxylate
Wiley ID 1255038