| SpectraBase Compound ID | GWmvxzRk209 |
|---|---|
| InChI | InChI=1S/C7H6N2/c8-6-9-7-4-2-1-3-5-7/h1-5,9H |
| InChIKey | JLXXLCJERIYMQG-UHFFFAOYSA-N |
| Mol Weight | 118.14 g/mol |
| Molecular Formula | C7H6N2 |
| Exact Mass | 118.053098 g/mol |
Vapor Phase (Gas) Infrared Spectrum
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| SpectraBase Spectrum ID | 7OMAImGkyfx |
|---|---|
| Name | N-Cyanoaniline;N-cyano-phenylamine |
| Comments | Computed using SmartSpectra Model v1.42 |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 118.053098201 u |
| Formula | C7H6N2 |
| InChI | InChI=1S/C7H6N2/c8-6-9-7-4-2-1-3-5-7/h1-5,9H |
| InChIKey | JLXXLCJERIYMQG-UHFFFAOYSA-N |
| Molecular Weight | 118.139 g/mol |
| SMILES | C(#N)NC=1C=CC=CC1 |
| Spectrum/Structure Validation Score (Vapor Phase IR) | 0.948561 |