| SpectraBase Compound ID | CAm3rQgugar |
|---|---|
| InChI | InChI=1S/C12H7NO2/c14-8-5-6-10-12(7-8)15-11-4-2-1-3-9(11)13-10/h1-7H |
| InChIKey | UOMHBFAJZRZNQD-UHFFFAOYSA-N |
| Mol Weight | 197.19 g/mol |
| Molecular Formula | C12H7NO2 |
| Exact Mass | 197.047678 g/mol |
Vapor Phase (Gas) Infrared Spectrum
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| SpectraBase Spectrum ID | 1mRqkBXhYO8 |
|---|---|
| Name | 3H-Phenoxazin-3-one |
| Comments | Computed using SmartSpectra Model v1.42 |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 197.047678467 u |
| Formula | C12H7NO2 |
| InChI | InChI=1S/C12H7NO2/c14-8-5-6-10-12(7-8)15-11-4-2-1-3-9(11)13-10/h1-7H |
| InChIKey | UOMHBFAJZRZNQD-UHFFFAOYSA-N |
| Molecular Weight | 197.193 g/mol |
| SMILES | C1(=O)C=CC=2C(=C1)OC1=CC=CC=C1N2 |
| Spectrum/Structure Validation Score (Vapor Phase IR) | 0.93563 |