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1-(4-Ethoxyphenyl)-3-(phenylcarbonyl)-4H-pyrrolo[3,2-b]quinoxalin-2-one
SpectraBase Compound ID JeWZVXwaX5
InChI InChI=1S/C25H19N3O3/c1-2-31-18-14-12-17(13-15-18)28-24-22(26-19-10-6-7-11-20(19)27-24)21(25(28)30)23(29)16-8-4-3-5-9-16/h3-15,26H,2H2,1H3
InChIKey RQYYQJDOKRYXBR-UHFFFAOYSA-N
Mol Weight 409.45 g/mol
Molecular Formula C25H19N3O3
Exact Mass 409.142641 g/mol

Vapor Phase (Gas) Infrared Spectrum

Vapor Phase (Gas) Infrared Spectrum

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SpectraBase Spectrum ID ERU2JcT1TBI
Name 1-(4-Ethoxyphenyl)-3-(phenylcarbonyl)-4H-pyrrolo[3,2-B]quinoxalin-2-one
Comments Computed using SmartSpectra Model v1.42
Copyright Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved.
Exact Mass 409.142641481 u
Formula C25H19N3O3
InChI InChI=1S/C25H19N3O3/c1-2-31-18-14-12-17(13-15-18)28-24-22(26-19-10-6-7-11-20(19)27-24)21(25(28)30)23(29)16-8-4-3-5-9-16/h3-15,26H,2H2,1H3
InChIKey RQYYQJDOKRYXBR-UHFFFAOYSA-N
Molecular Weight 409.445 g/mol
SMILES C12=NC=3C=CC=CC3NC2=C(C(N1C=1C=CC(=CC1)OCC)=O)C(C=1C=CC=CC1)=O
Spectrum/Structure Validation Score (Vapor Phase IR) 0.860998