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Pyrrolo[1,2-a]-1,3,5-triazine-7-carboxylic acid, 1,2,3,4-tetrahydro-2,4-dioxo-, ethyl ester
SpectraBase Compound ID 3b5N6o3OV7M
InChI InChI=1S/C9H9N3O4/c1-2-16-7(13)5-3-6-10-8(14)11-9(15)12(6)4-5/h3-4H,2H2,1H3,(H2,10,11,14,15)
InChIKey CJYAUHVRYDQIHG-UHFFFAOYSA-N
Mol Weight 223.19 g/mol
Molecular Formula C9H9N3O4
Exact Mass 223.059306 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID LgIO2iEQ8mo
Name Pyrrolo[1,2-a]-1,3,5-triazine-7-carboxylic acid, 1,2,3,4-tetrahydro-2,4-dioxo-, ethyl ester
CAS Registry Number 54449-89-7
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C9H9N3O4
InChI InChI=1S/C9H9N3O4/c1-2-16-7(13)5-3-6-10-8(14)11-9(15)12(6)4-5/h3-4H,2H2,1H3,(H2,10,11,14,15)
InChIKey CJYAUHVRYDQIHG-UHFFFAOYSA-N
Molecular Weight 223.188 g/mol
SMILES N1C(NC([n]2cc(cc12)C(=O)OCC)=O)=O
SPLASH splash10-00g0-0940000000-a870f2073181fbc23904
Source of Spectrum O-10-433-1
Synonyms Ethyl 2,4-dioxo-1,2,3,4-tetrahydropyrrolo[1,2-a][1,3,5]triazine-7-carboxylate 2,4-Diketo-1H-pyrrolo[1,2-a][1,3,5]triazine-7-carboxylic acid ethyl ester 2,4-Dioxo-1H-pyrrolo[1,2-a][1,3,5]triazine-7-carboxylic acid ethyl ester Ethyl 2,4-bis(oxidanylidene)-1H-pyrrolo[1,2-a][1,3,5]triazine-7-carboxylate Ethyl 2,4-dioxo-1H-pyrrolo[1,2-a][1,3,5]triazine-7-carboxylate
Wiley ID 1223765