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Ethyl 1,2,3,4-tetrahydro-2-oxoquinoline-4-carboxylate

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Ethyl 1,2,3,4-tetrahydro-2-oxoquinoline-4-carboxylate
SpectraBase Compound ID CrPYvAhIUhs
InChI InChI=1S/C12H13NO3/c1-2-16-12(15)9-7-11(14)13-10-6-4-3-5-8(9)10/h3-6,9H,2,7H2,1H3,(H,13,14)
InChIKey WSBUDAJUVYHBLM-UHFFFAOYSA-N
Mol Weight 219.24 g/mol
Molecular Formula C12H13NO3
Exact Mass 219.089543 g/mol

Vapor Phase (Gas) Infrared Spectrum

Vapor Phase (Gas) Infrared Spectrum

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SpectraBase Spectrum ID H2iay65GRvN
Name Ethyl 1,2,3,4-tetrahydro-2-oxoquinoline-4-carboxylate
Comments Computed using SmartSpectra Model v1.42
Copyright Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved.
Exact Mass 219.089543280 u
Formula C12H13NO3
InChI InChI=1S/C12H13NO3/c1-2-16-12(15)9-7-11(14)13-10-6-4-3-5-8(9)10/h3-6,9H,2,7H2,1H3,(H,13,14)
InChIKey WSBUDAJUVYHBLM-UHFFFAOYSA-N
Molecular Weight 219.240 g/mol
SMILES C12=C(C=CC=C2)NC(CC1C(=O)OCC)=O
Spectrum/Structure Validation Score (Vapor Phase IR) 0.962045