| SpectraBase Compound ID | FzUAtPQ9q37 |
|---|---|
| InChI | InChI=1S/C16H11NO2S/c18-20(19)15-8-4-3-7-13(15)17-14-10-9-11-5-1-2-6-12(11)16(14)20/h1-10,17H |
| InChIKey | YWXWUJJJMZJRNZ-UHFFFAOYSA-N |
| Mol Weight | 281.33 g/mol |
| Molecular Formula | C16H11NO2S |
| Exact Mass | 281.05105 g/mol |
Vapor Phase (Gas) Infrared Spectrum
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| SpectraBase Spectrum ID | Dt1pkqUXwQW |
|---|---|
| Name | 6,7-Benzo-phenothiazine-5,5-dioxide |
| Comments | Computed using SmartSpectra Model v1.42 |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 281.051049770 u |
| Formula | C16H11NO2S |
| InChI | InChI=1S/C16H11NO2S/c18-20(19)15-8-4-3-7-13(15)17-14-10-9-11-5-1-2-6-12(11)16(14)20/h1-10,17H |
| InChIKey | YWXWUJJJMZJRNZ-UHFFFAOYSA-N |
| SMILES | C12=CC=CC=C2C=CC2=C1S(C=1C(N2)=CC=CC1)(=O)=O |
| Spectrum/Structure Validation Score (Vapor Phase IR) | 0.921222 |