| SpectraBase Compound ID | 3f30lVAssEd |
|---|---|
| InChI | InChI=1S/C10H12FNO/c1-7(12-2)10(13)8-3-5-9(11)6-4-8/h3-7,12H,1-2H3 |
| InChIKey | MWKQPIROPJSFRI-UHFFFAOYSA-N |
| Mol Weight | 181.21 g/mol |
| Molecular Formula | C10H12FNO |
| Exact Mass | 181.090292 g/mol |
Vapor Phase (Gas) Infrared Spectrum
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| SpectraBase Spectrum ID | 4diOlwkzLgz |
|---|---|
| Name | 4-Fluoro-methcathinone |
| Comments | Computed using SmartSpectra Model v1.42 |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 181.090292172 u |
| Formula | C10H12FNO |
| InChI | InChI=1S/C10H12FNO/c1-7(12-2)10(13)8-3-5-9(11)6-4-8/h3-7,12H,1-2H3 |
| InChIKey | MWKQPIROPJSFRI-UHFFFAOYSA-N |
| Molecular Weight | 181.210 g/mol |
| SMILES | C(=O)(C(C)NC)C1=CC=C(F)C=C1 |
| Spectrum/Structure Validation Score (Vapor Phase IR) | 0.936701 |