| SpectraBase Compound ID | Bte6Xko0hsu |
|---|---|
| InChI | InChI=1S/C10H7NO2/c12-9-6-8(11-10(9)13)7-4-2-1-3-5-7/h1-6H,(H,11,12,13) |
| InChIKey | GHURLMDZQKAWAS-UHFFFAOYSA-N |
| Mol Weight | 173.17 g/mol |
| Molecular Formula | C10H7NO2 |
| Exact Mass | 173.047678 g/mol |
Vapor Phase (Gas) Infrared Spectrum
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| SpectraBase Spectrum ID | GHbJedyhETz |
|---|---|
| Name | 5-Phenyl-2,3-dihydropyrrole-2,3-dione |
| Comments | Computed using SmartSpectra Model v1.42 |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 173.047678467 u |
| Formula | C10H7NO2 |
| InChI | InChI=1S/C10H7NO2/c12-9-6-8(11-10(9)13)7-4-2-1-3-5-7/h1-6H,(H,11,12,13) |
| InChIKey | GHURLMDZQKAWAS-UHFFFAOYSA-N |
| Molecular Weight | 173.171 g/mol |
| SMILES | C=1(NC(C(C1)=O)=O)C=1C=CC=CC1 |
| Spectrum/Structure Validation Score (Vapor Phase IR) | 0.967049 |