| SpectraBase Compound ID | CKkU9R7AgnP |
|---|---|
| InChI | InChI=1S/C13H9NO2/c14-8-5-6-12-10(7-8)13(15)9-3-1-2-4-11(9)16-12/h1-7H,14H2 |
| InChIKey | JIDPRRVEJMGZKE-UHFFFAOYSA-N |
| Mol Weight | 211.22 g/mol |
| Molecular Formula | C13H9NO2 |
| Exact Mass | 211.063329 g/mol |
Vapor Phase (Gas) Infrared Spectrum
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| SpectraBase Spectrum ID | FI5KR9PcNA |
|---|---|
| Name | 2-Aminoxanthone |
| Comments | Computed using SmartSpectra Model v1.42 |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 211.063328532 u |
| Formula | C13H9NO2 |
| InChI | InChI=1S/C13H9NO2/c14-8-5-6-12-10(7-8)13(15)9-3-1-2-4-11(9)16-12/h1-7H,14H2 |
| InChIKey | JIDPRRVEJMGZKE-UHFFFAOYSA-N |
| Molecular Weight | 211.220 g/mol |
| SMILES | C1(C=2C=C(C=CC2OC=2C=CC=CC12)N)=O |
| Spectrum/Structure Validation Score (Vapor Phase IR) | 0.843326 |