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4-Ethyl-2-(4-nitrophenyl)-4,5-dihydrooxazole

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

4-Ethyl-2-(4-nitrophenyl)-4,5-dihydrooxazole
SpectraBase Compound ID BhciLyql1d7
InChI InChI=1S/C11H12N2O3/c1-2-9-7-16-11(12-9)8-3-5-10(6-4-8)13(14)15/h3-6,9H,2,7H2,1H3
InChIKey HTARZZXBPVIERF-UHFFFAOYSA-N
Mol Weight 220.23 g/mol
Molecular Formula C11H12N2O3
Exact Mass 220.084792 g/mol

Vapor Phase (Gas) Infrared Spectrum

Vapor Phase (Gas) Infrared Spectrum

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SpectraBase Spectrum ID 1xQkXBV5cKM
Name 4-Ethyl-2-(4-nitrophenyl)-4,5-dihydrooxazole
Comments Computed using SmartSpectra Model v1.42
Copyright Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved.
Exact Mass 220.084792251 u
Formula C11H12N2O3
InChI InChI=1S/C11H12N2O3/c1-2-9-7-16-11(12-9)8-3-5-10(6-4-8)13(14)15/h3-6,9H,2,7H2,1H3
InChIKey HTARZZXBPVIERF-UHFFFAOYSA-N
Molecular Weight 220.228 g/mol
SMILES C=1(OCC(N1)CC)C=1C=CC(=CC1)N(=O)=O
Spectrum/Structure Validation Score (Vapor Phase IR) 0.954695