| SpectraBase Compound ID | 1O103A1ame1 |
|---|---|
| InChI | InChI=1S/C12H8N2/c13-7-9-5-10-3-1-2-4-12(10)11(6-9)8-14/h1-5,11H,6H2 |
| InChIKey | RVSQJPREHZHLEM-UHFFFAOYSA-N |
| Mol Weight | 180.21 g/mol |
| Molecular Formula | C12H8N2 |
| Exact Mass | 180.068748 g/mol |
Vapor Phase (Gas) Infrared Spectrum
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| SpectraBase Spectrum ID | GErPcjZQevg |
|---|---|
| Name | 1,2-Dihydronaphthalene-1,3-dicarbonitrile |
| Comments | Computed using SmartSpectra Model v1.42 |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 180.068748266 u |
| Formula | C12H8N2 |
| InChI | InChI=1S/C12H8N2/c13-7-9-5-10-3-1-2-4-12(10)11(6-9)8-14/h1-5,11H,6H2 |
| InChIKey | RVSQJPREHZHLEM-UHFFFAOYSA-N |
| Molecular Weight | 180.210 g/mol |
| SMILES | C1(CC(=CC=2C=CC=CC12)C#N)C#N |
| Spectrum/Structure Validation Score (Vapor Phase IR) | 0.804818 |