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7-(4-nitrophenyl)-8-(phenylcarbonyl)-2,3,6,7-tetrahydro-1H-imidazo[1,2-a]pyridin-5-one
SpectraBase Compound ID De9PTovnQBt
InChI InChI=1S/C20H17N3O4/c24-17-12-16(13-6-8-15(9-7-13)23(26)27)18(20-21-10-11-22(17)20)19(25)14-4-2-1-3-5-14/h1-9,16,21H,10-12H2
InChIKey ADZQDTDWXFHMLE-UHFFFAOYSA-N
Mol Weight 363.37 g/mol
Molecular Formula C20H17N3O4
Exact Mass 363.121906 g/mol

Vapor Phase (Gas) Infrared Spectrum

Vapor Phase (Gas) Infrared Spectrum

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SpectraBase Spectrum ID 8YwYTKNjtBn
Name 7-(4-Nitrophenyl)-8-(phenylcarbonyl)-2,3,6,7-tetrahydro-1H-imidazo[1,2-A]pyridin-5-one
Comments Computed using SmartSpectra Model v1.42
Copyright Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved.
Exact Mass 363.121906035 u
Formula C20H17N3O4
InChI InChI=1S/C20H17N3O4/c24-17-12-16(13-6-8-15(9-7-13)23(26)27)18(20-21-10-11-22(17)20)19(25)14-4-2-1-3-5-14/h1-9,16,21H,10-12H2
InChIKey ADZQDTDWXFHMLE-UHFFFAOYSA-N
Molecular Weight 363.373 g/mol
SMILES C1(=C2N(CCN2)C(CC1C1=CC=C(N(=O)=O)C=C1)=O)C(=O)C1=CC=CC=C1
Spectrum/Structure Validation Score (Vapor Phase IR) 0.812822