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4-(2H-1,3-Benzodioxol-5-yl)-7-hydroxy-3,4-dihydro-1H-quinolin-2-one

View entire compound with spectra: 1 FTIR

4-(2H-1,3-Benzodioxol-5-yl)-7-hydroxy-3,4-dihydro-1H-quinolin-2-one
SpectraBase Compound ID 8tWTiUbCQM8
InChI InChI=1S/C16H13NO4/c18-10-2-3-11-12(7-16(19)17-13(11)6-10)9-1-4-14-15(5-9)21-8-20-14/h1-6,12,18H,7-8H2,(H,17,19)
InChIKey LXJCUNFWNMWUQT-UHFFFAOYSA-N
Mol Weight 283.28 g/mol
Molecular Formula C16H13NO4
Exact Mass 283.084458 g/mol

Vapor Phase (Gas) Infrared Spectrum

Vapor Phase (Gas) Infrared Spectrum

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SpectraBase Spectrum ID EQZ1Ss5WzZq
Name 4-(2H-1,3-Benzodioxol-5-yl)-7-hydroxy-3,4-dihydro-1H-quinolin-2-one
Comments Computed using SmartSpectra Model v1.42
Copyright Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved.
Exact Mass 283.084457899 u
Formula C16H13NO4
InChI InChI=1S/C16H13NO4/c18-10-2-3-11-12(7-16(19)17-13(11)6-10)9-1-4-14-15(5-9)21-8-20-14/h1-6,12,18H,7-8H2,(H,17,19)
InChIKey LXJCUNFWNMWUQT-UHFFFAOYSA-N
SMILES C1=2NC(=O)CC(C2C=CC(=C1)O)C1=CC=2OCOC2C=C1
Spectrum/Structure Validation Score (Vapor Phase IR) 0.927321