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Acetic acid, 2-[methyl(2,3,4,5-tetrahydro-3,5-dioxo-1,2,4-triazin-6-yl)amino]-
SpectraBase Compound ID 2CRyxwP2mm5
InChI InChI=1S/C6H8N4O4/c1-10(2-3(11)12)4-5(13)7-6(14)9-8-4/h2H2,1H3,(H,11,12)(H2,7,9,13,14)
InChIKey ORKIPYVTIXFVMB-UHFFFAOYSA-N
Mol Weight 200.15 g/mol
Molecular Formula C6H8N4O4
Exact Mass 200.054555 g/mol

Vapor Phase (Gas) Infrared Spectrum

Vapor Phase (Gas) Infrared Spectrum

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SpectraBase Spectrum ID LD1dPKyfsGt
Name Acetic acid, 2-[methyl(2,3,4,5-tetrahydro-3,5-dioxo-1,2,4-triazin-6-yl)amino]-
Comments Computed using SmartSpectra Model v1.42
Copyright Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved.
Exact Mass 200.054554750 u
Formula C6H8N4O4
InChI InChI=1S/C6H8N4O4/c1-10(2-3(11)12)4-5(13)7-6(14)9-8-4/h2H2,1H3,(H,11,12)(H2,7,9,13,14)
InChIKey ORKIPYVTIXFVMB-UHFFFAOYSA-N
Molecular Weight 200.154 g/mol
SMILES CN(CC(O)=O)C=1C(NC(=O)NN1)=O
Spectrum/Structure Validation Score (Vapor Phase IR) 0.938053