| SpectraBase Compound ID | 4LZiK1K0D3F |
|---|---|
| InChI | InChI=1S/C16H16ClNS/c17-11-5-6-12-18-13-7-1-3-9-15(13)19-16-10-4-2-8-14(16)18/h1-4,7-10H,5-6,11-12H2 |
| InChIKey | KPHGVVFQTSDDTR-UHFFFAOYSA-N |
| Mol Weight | 289.82 g/mol |
| Molecular Formula | C16H16ClNS |
| Exact Mass | 289.069198 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | 3gvjOTFDP7W |
|---|---|
| Name | 10H-Phenothiazine, 10-(4-chlorobutyl)- |
| Comments | Computed using HOSE algorithm |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 289.069198393 u |
| Formula | C16H16ClNS |
| InChI | InChI=1S/C16H16ClNS/c17-11-5-6-12-18-13-7-1-3-9-15(13)19-16-10-4-2-8-14(16)18/h1-4,7-10H,5-6,11-12H2 |
| InChIKey | KPHGVVFQTSDDTR-UHFFFAOYSA-N |
| SMILES | C(CCCN1C2=C(C=CC=C2)SC2=C1C=CC=C2)Cl |