| SpectraBase Compound ID | 2sYPX3vd1sw |
|---|---|
| InChI | InChI=1S/C7H12FNO/c1-6(10)9-4-2-3-7(9)5-8/h7H,2-5H2,1H3 |
| InChIKey | LYQKOTHFKDGANB-UHFFFAOYSA-N |
| Mol Weight | 145.18 g/mol |
| Molecular Formula | C7H12FNO |
| Exact Mass | 145.090292 g/mol |
Vapor Phase (Gas) Infrared Spectrum
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| SpectraBase Spectrum ID | GAdW5wuX3HN |
|---|---|
| Name | 2-(Fluoromethyl)pyrrolidine, N-acetyl |
| Comments | Computed using SmartSpectra Model v1.42 |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 145.090292172 u |
| Formula | C7H12FNO |
| InChI | InChI=1S/C7H12FNO/c1-6(10)9-4-2-3-7(9)5-8/h7H,2-5H2,1H3 |
| InChIKey | LYQKOTHFKDGANB-UHFFFAOYSA-N |
| Molecular Weight | 145.177 g/mol |
| SMILES | CC(=O)N1CCCC1CF |
| Spectrum/Structure Validation Score (Vapor Phase IR) | 0.920069 |