| SpectraBase Compound ID | 8W8solLhP7T |
|---|---|
| InChI | InChI=1S/C20H24ClNS/c1-2-3-4-5-6-9-14-22-17-10-7-8-11-19(17)23-20-13-12-16(21)15-18(20)22/h7-8,10-13,15H,2-6,9,14H2,1H3 |
| InChIKey | YRIQMGICCGGQLR-UHFFFAOYSA-N |
| Mol Weight | 345.93 g/mol |
| Molecular Formula | C20H24ClNS |
| Exact Mass | 345.131799 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | 7LS4MFS7Ucq |
|---|---|
| Name | 2-Chloranyl-10-octyl-phenothiazine |
| Comments | Computed using HOSE algorithm |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 345.131798651 u |
| Formula | C20H24ClNS |
| InChI | InChI=1S/C20H24ClNS/c1-2-3-4-5-6-9-14-22-17-10-7-8-11-19(17)23-20-13-12-16(21)15-18(20)22/h7-8,10-13,15H,2-6,9,14H2,1H3 |
| InChIKey | YRIQMGICCGGQLR-UHFFFAOYSA-N |
| Molecular Weight | 345.932 g/mol |
| SMILES | C=12N(C3=C(SC2=CC=C(C1)Cl)C=CC=C3)CCCCCCCC |