| SpectraBase Compound ID | 3CMxSTIj6XO |
|---|---|
| InChI | InChI=1S/C14H11NO3S/c1-17-9-3-4-10-12(7-9)19-13-6-8(16)5-11(18-2)14(13)15-10/h3-7H,1-2H3 |
| InChIKey | OXZUZKIHAACLJM-UHFFFAOYSA-N |
| Mol Weight | 273.31 g/mol |
| Molecular Formula | C14H11NO3S |
| Exact Mass | 273.045964 g/mol |
Raman Spectrum
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| SpectraBase Spectrum ID | HrPMNxY5mBL |
|---|---|
| Name | 1,7-Dimethoxy-3H-phenothiazin-3-one |
| Comments | Computed using SmartSpectra Model v1.42 |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 273.045964389 u |
| Formula | C14H11NO3S |
| InChI | InChI=1S/C14H11NO3S/c1-17-9-3-4-10-12(7-9)19-13-6-8(16)5-11(18-2)14(13)15-10/h3-7H,1-2H3 |
| InChIKey | OXZUZKIHAACLJM-UHFFFAOYSA-N |
| SMILES | C1=CC(=CC2=C1N=C1C(=CC(=O)C=C1S2)OC)OC |
| Spectrum/Structure Validation Score (Raman) | 0.947434 |