| SpectraBase Compound ID | D8n22UlTRXH |
|---|---|
| InChI | InChI=1S/C13H9ClFNO/c14-9-4-3-5-10(8-9)16-13(17)11-6-1-2-7-12(11)15/h1-8H,(H,16,17) |
| InChIKey | ACCUIVLHACNVHQ-UHFFFAOYSA-N |
| Mol Weight | 249.67 g/mol |
| Molecular Formula | C13H9ClFNO |
| Exact Mass | 249.03567 g/mol |
Raman Spectrum
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| SpectraBase Spectrum ID | AKPjD5QHF3H |
|---|---|
| Name | 3'-Chloro-2-fluorobenzanilide |
| Comments | Computed using SmartSpectra Model v1.42 |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 249.035669776 u |
| Formula | C13H9ClFNO |
| InChI | InChI=1S/C13H9ClFNO/c14-9-4-3-5-10(8-9)16-13(17)11-6-1-2-7-12(11)15/h1-8H,(H,16,17) |
| InChIKey | ACCUIVLHACNVHQ-UHFFFAOYSA-N |
| Molecular Weight | 249.672 g/mol |
| SMILES | N(C1=CC=CC(=C1)Cl)C(C=1C(=CC=CC1)F)=O |
| Spectrum/Structure Validation Score (Raman) | 0.745987 |