| SpectraBase Compound ID | FN9RD0mIwBR |
|---|---|
| InChI | InChI=1S/C12H8FNS/c13-8-5-6-10-12(7-8)15-11-4-2-1-3-9(11)14-10/h1-7,14H |
| InChIKey | PNDZYFUALQXWOY-UHFFFAOYSA-N |
| Mol Weight | 217.26 g/mol |
| Molecular Formula | C12H8FNS |
| Exact Mass | 217.036149 g/mol |
Vapor Phase (Gas) Infrared Spectrum
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| SpectraBase Spectrum ID | 2gDXzLPtweq |
|---|---|
| Name | 3-Fluoro-10H-phenothiazine |
| Comments | Computed using SmartSpectra Model v1.42 |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 217.036148599 u |
| Formula | C12H8FNS |
| InChI | InChI=1S/C12H8FNS/c13-8-5-6-10-12(7-8)15-11-4-2-1-3-9(11)14-10/h1-7,14H |
| InChIKey | PNDZYFUALQXWOY-UHFFFAOYSA-N |
| Molecular Weight | 217.261 g/mol |
| SMILES | C1(F)=CC2=C(C=C1)NC1=C(S2)C=CC=C1 |
| Spectrum/Structure Validation Score (Vapor Phase IR) | 0.925547 |