| SpectraBase Compound ID | 36ZVY2yq4TH |
|---|---|
| InChI | InChI=1S/C10H8N2/c11-7-10(8-12)6-9-4-2-1-3-5-9/h1-5,10H,6H2 |
| InChIKey | ODFHXXQVNHHDDG-UHFFFAOYSA-N |
| Mol Weight | 156.19 g/mol |
| Molecular Formula | C10H8N2 |
| Exact Mass | 156.068748 g/mol |
Vapor Phase (Gas) Infrared Spectrum
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| SpectraBase Spectrum ID | KpC1pHv9uMR |
|---|---|
| Name | 2-Benzylidene-malononitrile |
| Comments | Computed using SmartSpectra Model v1.42 |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 156.068748266 u |
| Formula | C10H8N2 |
| InChI | InChI=1S/C10H8N2/c11-7-10(8-12)6-9-4-2-1-3-5-9/h1-5,10H,6H2 |
| InChIKey | ODFHXXQVNHHDDG-UHFFFAOYSA-N |
| Molecular Weight | 156.188 g/mol |
| SMILES | C(#N)C(C#N)CC1=CC=CC=C1 |
| Spectrum/Structure Validation Score (Vapor Phase IR) | 0.943488 |