| SpectraBase Compound ID | CihXPAOJOzn |
|---|---|
| InChI | InChI=1S/C16H13ClF3NS/c17-8-3-9-21-12-4-1-2-5-14(12)22-15-7-6-11(10-13(15)21)16(18,19)20/h1-2,4-7,10H,3,8-9H2 |
| InChIKey | BZEJZIAESDBOJX-UHFFFAOYSA-N |
| Mol Weight | 343.8 g/mol |
| Molecular Formula | C16H13ClF3NS |
| Exact Mass | 343.040933 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | K5mgyxnOTTL |
|---|---|
| Name | 10-(3-Chloro-propyl)-2-trifluoromethyl-10H-phenothiazine |
| Comments | Computed using HOSE algorithm |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 343.040932786 u |
| Formula | C16H13ClF3NS |
| InChI | InChI=1S/C16H13ClF3NS/c17-8-3-9-21-12-4-1-2-5-14(12)22-15-7-6-11(10-13(15)21)16(18,19)20/h1-2,4-7,10H,3,8-9H2 |
| InChIKey | BZEJZIAESDBOJX-UHFFFAOYSA-N |
| Molecular Weight | 343.795 g/mol |
| SMILES | C1=2SC=3C(N(C1=CC=CC2)CCCCl)=CC(=CC3)C(F)(F)F |