| SpectraBase Compound ID | FLHLpnOsoTP |
|---|---|
| InChI | InChI=1S/C10H8ClN/c11-9-3-1-8(2-4-9)10(7-12)5-6-10/h1-4H,5-6H2 |
| InChIKey | BVWSEHMDAKSWQW-UHFFFAOYSA-N |
| Mol Weight | 177.63 g/mol |
| Molecular Formula | C10H8ClN |
| Exact Mass | 177.034527 g/mol |
Raman Spectrum
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| SpectraBase Spectrum ID | KQ3Ilb1C0bd |
|---|---|
| Name | 1-(p-Chlorophenyl)cyclopropanecarbonitrile |
| Comments | Computed using SmartSpectra Model v1.42 |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 177.034526962 u |
| Formula | C10H8ClN |
| InChI | InChI=1S/C10H8ClN/c11-9-3-1-8(2-4-9)10(7-12)5-6-10/h1-4H,5-6H2 |
| InChIKey | BVWSEHMDAKSWQW-UHFFFAOYSA-N |
| Molecular Weight | 177.634 g/mol |
| SMILES | C1CC1(C=1C=CC(=CC1)Cl)C#N |
| Spectrum/Structure Validation Score (Raman) | 0.891416 |