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3-[1-(2-Hydroxy-ethylamino)-ethylidene]-chroman-2,4-dione

View entire compound with spectra: 1 NMR, 1 FTIR, and 1 MS (GC)

3-[1-(2-Hydroxy-ethylamino)-ethylidene]-chroman-2,4-dione
SpectraBase Compound ID 175VjWczwzf
InChI InChI=1S/C13H13NO4/c1-8(14-6-7-15)11-12(16)9-4-2-3-5-10(9)18-13(11)17/h2-5,14-15H,6-7H2,1H3/b11-8+
InChIKey RLUIENNINVVHFX-DHZHZOJOSA-N
Mol Weight 247.25 g/mol
Molecular Formula C13H13NO4
Exact Mass 247.084458 g/mol

Vapor Phase (Gas) Infrared Spectrum

Vapor Phase (Gas) Infrared Spectrum

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SpectraBase Spectrum ID JJFdeaQaFYD
Name 3-[1-(2-Hydroxy-ethylamino)-ethylidene]-chroman-2,4-dione
Comments Computed using SmartSpectra Model v1.42
Copyright Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved.
Exact Mass 247.084457899 u
Formula C13H13NO4
InChI InChI=1S/C13H13NO4/c1-8(14-6-7-15)11-12(16)9-4-2-3-5-10(9)18-13(11)17/h2-5,14-15H,6-7H2,1H3/b11-8+
InChIKey RLUIENNINVVHFX-DHZHZOJOSA-N
Molecular Weight 247.250 g/mol
SMILES C1(\C(C(C=2C(O1)=CC=CC2)=O)=C/(NCCO)C)=O
Spectrum/Structure Validation Score (Vapor Phase IR) 0.948204