![Bicyclo[2.2.1]hept-5-ene-2-carbonitrile, 3-methylene-](/api/spectrum/7l6sIZHYgfa/structure.png?h=300&w=458 "Bicyclo[2.2.1]hept-5-ene-2-carbonitrile, 3-methylene-")
| SpectraBase Compound ID | EZHqESYAcJE |
|---|---|
| InChI | InChI=1S/C9H9N/c1-6-7-2-3-8(4-7)9(6)5-10/h2-3,7-9H,1,4H2 |
| InChIKey | MOLMBOUBIKGPJA-UHFFFAOYSA-N |
| Mol Weight | 131.18 g/mol |
| Molecular Formula | C9H9N |
| Exact Mass | 131.073499 g/mol |
Vapor Phase (Gas) Infrared Spectrum
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| SpectraBase Spectrum ID | 7l6sIZHYgfa |
|---|---|
| Name | Bicyclo[2.2.1]hept-5-ene-2-carbonitrile, 3-methylene- |
| Comments | Computed using SmartSpectra Model v1.42 |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 131.073499294 u |
| Formula | C9H9N |
| InChI | InChI=1S/C9H9N/c1-6-7-2-3-8(4-7)9(6)5-10/h2-3,7-9H,1,4H2 |
| InChIKey | MOLMBOUBIKGPJA-UHFFFAOYSA-N |
| Molecular Weight | 131.178 g/mol |
| SMILES | C1=CC2C(C(C1C2)=C)C#N |
| Spectrum/Structure Validation Score (Vapor Phase IR) | 0.847713 |