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N-(Aminocarbonyl)-3-hydroxy-5,6-dimethoxy-2-oxoindoline-3-carboxamide
SpectraBase Compound ID 7hZajgr1nWf
InChI InChI=1S/C12H13N3O6/c1-20-7-3-5-6(4-8(7)21-2)14-9(16)12(5,19)10(17)15-11(13)18/h3-4,19H,1-2H3,(H,14,16)(H3,13,15,17,18)
InChIKey IBXYPPWMQWZHQW-UHFFFAOYSA-N
Mol Weight 295.25 g/mol
Molecular Formula C12H13N3O6
Exact Mass 295.080435 g/mol

Vapor Phase (Gas) Infrared Spectrum

Vapor Phase (Gas) Infrared Spectrum

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SpectraBase Spectrum ID LUI7SnFAPzh
Name N-(Aminocarbonyl)-3-hydroxy-5,6-dimethoxy-2-oxoindoline-3-carboxamide
Comments Computed using SmartSpectra Model v1.42
Copyright Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved.
Exact Mass 295.080435145 u
Formula C12H13N3O6
InChI InChI=1S/C12H13N3O6/c1-20-7-3-5-6(4-8(7)21-2)14-9(16)12(5,19)10(17)15-11(13)18/h3-4,19H,1-2H3,(H,14,16)(H3,13,15,17,18)
InChIKey IBXYPPWMQWZHQW-UHFFFAOYSA-N
Molecular Weight 295.251 g/mol
SMILES C1=C2C(=CC(=C1OC)OC)C(C(NC(N)=O)=O)(O)C(N2)=O
Spectrum/Structure Validation Score (Vapor Phase IR) 0.863419