| SpectraBase Compound ID | GhdjLTHYKN4 |
|---|---|
| InChI | InChI=1S/C15H9ClF3NOS/c16-8-14(21)20-10-3-1-2-4-12(10)22-13-6-5-9(7-11(13)20)15(17,18)19/h1-7H,8H2 |
| InChIKey | NAQGVVKCOQMRPX-UHFFFAOYSA-N |
| Mol Weight | 343.75 g/mol |
| Molecular Formula | C15H9ClF3NOS |
| Exact Mass | 343.004547 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | Br6SxFlTWmy |
|---|---|
| Name | 2-Chloro-1-(2-trifluoromethyl-phenothiazin-10-yl)-ethanone |
| Comments | Computed using HOSE algorithm |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 343.004547276 u |
| Formula | C15H9ClF3NOS |
| InChI | InChI=1S/C15H9ClF3NOS/c16-8-14(21)20-10-3-1-2-4-12(10)22-13-6-5-9(7-11(13)20)15(17,18)19/h1-7H,8H2 |
| InChIKey | NAQGVVKCOQMRPX-UHFFFAOYSA-N |
| Molecular Weight | 343.751 g/mol |
| SMILES | C1=CC=C2N(C3=C(C=CC(=C3)C(F)(F)F)SC2=C1)C(=O)CCl |