| SpectraBase Compound ID | kuBjgueSnj |
|---|---|
| InChI | InChI=1S/C16H15NO2S/c1-18-13-8-12-15(9-14(13)19-2)20-10-17-16(12)11-6-4-3-5-7-11/h3-9H,10H2,1-2H3 |
| InChIKey | NXMFYYQURYQPMO-UHFFFAOYSA-N |
| Mol Weight | 285.36 g/mol |
| Molecular Formula | C16H15NO2S |
| Exact Mass | 285.08235 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | 8amp9aTcVBN |
|---|---|
| Name | 6,7-Dimethoxy-4-phenyl-2H-1,3-benzothiazine |
| Comments | Computed using HOSE algorithm |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 285.082349899 u |
| Formula | C16H15NO2S |
| InChI | InChI=1S/C16H15NO2S/c1-18-13-8-12-15(9-14(13)19-2)20-10-17-16(12)11-6-4-3-5-7-11/h3-9H,10H2,1-2H3 |
| InChIKey | NXMFYYQURYQPMO-UHFFFAOYSA-N |
| SMILES | C=12C(=NCSC2=CC(=C(C1)OC)OC)C=1C=CC=CC1 |