| SpectraBase Compound ID | HrgeNF4756K |
|---|---|
| InChI | InChI=1S/C9H8FN/c1-7(6-11)8-2-4-9(10)5-3-8/h2-5,7H,1H3 |
| InChIKey | JPTHCYFZRSLQMW-UHFFFAOYSA-N |
| Mol Weight | 149.17 g/mol |
| Molecular Formula | C9H8FN |
| Exact Mass | 149.064077 g/mol |
Raman Spectrum
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| SpectraBase Spectrum ID | AWqBmMCptpo |
|---|---|
| Name | p-Fluorohydratroponitrile |
| Comments | Computed using SmartSpectra Model v1.42 |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 149.064077425 u |
| Formula | C9H8FN |
| InChI | InChI=1S/C9H8FN/c1-7(6-11)8-2-4-9(10)5-3-8/h2-5,7H,1H3 |
| InChIKey | JPTHCYFZRSLQMW-UHFFFAOYSA-N |
| Molecular Weight | 149.168 g/mol |
| SMILES | C(#N)C(C=1C=CC(=CC1)F)C |
| Spectrum/Structure Validation Score (Raman) | 0.80431 |