| SpectraBase Compound ID | H2lEgBgKDYl |
|---|---|
| InChI | InChI=1S/C9H8FNO/c1-2-9(12)11-8-5-3-4-7(10)6-8/h2-6H,1H2,(H,11,12) |
| InChIKey | VUJVAXXKUPXVPM-UHFFFAOYSA-N |
| Mol Weight | 165.17 g/mol |
| Molecular Formula | C9H8FNO |
| Exact Mass | 165.058992 g/mol |
Vapor Phase (Gas) Infrared Spectrum
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| SpectraBase Spectrum ID | 7SvnrJo1Xv1 |
|---|---|
| Name | N-(3-Fluorophenyl)prop-2-enamide |
| Comments | Computed using SmartSpectra Model v1.42 |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 165.058992044 u |
| Formula | C9H8FNO |
| InChI | InChI=1S/C9H8FNO/c1-2-9(12)11-8-5-3-4-7(10)6-8/h2-6H,1H2,(H,11,12) |
| InChIKey | VUJVAXXKUPXVPM-UHFFFAOYSA-N |
| Molecular Weight | 165.167 g/mol |
| SMILES | C1(NC(C=C)=O)=CC(=CC=C1)F |
| Spectrum/Structure Validation Score (Vapor Phase IR) | 0.964224 |