| SpectraBase Compound ID | I2zVyTFByyZ |
|---|---|
| InChI | InChI=1S/C4H3NO/c6-4-2-1-3-5-4/h1-3H |
| InChIKey | VIXWGKYSYIBATJ-UHFFFAOYSA-N |
| Mol Weight | 81.07 g/mol |
| Molecular Formula | C4H3NO |
| Exact Mass | 81.021464 g/mol |
Vapor Phase (Gas) Infrared Spectrum
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| SpectraBase Spectrum ID | DylUIQo4gL |
|---|---|
| Name | Pyrrol-2-one |
| Comments | Computed using SmartSpectra Model v1.42 |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 81.021463720 u |
| Formula | C4H3NO |
| InChI | InChI=1S/C4H3NO/c6-4-2-1-3-5-4/h1-3H |
| InChIKey | VIXWGKYSYIBATJ-UHFFFAOYSA-N |
| Molecular Weight | 81.074 g/mol |
| SMILES | C1(N=CC=C1)=O |
| Spectrum/Structure Validation Score (Vapor Phase IR) | 0.972537 |