| SpectraBase Compound ID | I89yMNB7BFZ |
|---|---|
| InChI | InChI=1S/C11H7NO/c12-7-8-1-2-9-3-4-11(13)6-10(9)5-8/h1-6,13H |
| InChIKey | NFBPHZSDBOVNAL-UHFFFAOYSA-N |
| Mol Weight | 169.18 g/mol |
| Molecular Formula | C11H7NO |
| Exact Mass | 169.052764 g/mol |
Vapor Phase (Gas) Infrared Spectrum
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| SpectraBase Spectrum ID | 6j5uisbkwsX |
|---|---|
| Name | 7-Hydroxy-2-naphthalenecarbonitrile |
| Comments | Computed using SmartSpectra Model v1.42 |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 169.052763848 u |
| Formula | C11H7NO |
| InChI | InChI=1S/C11H7NO/c12-7-8-1-2-9-3-4-11(13)6-10(9)5-8/h1-6,13H |
| InChIKey | NFBPHZSDBOVNAL-UHFFFAOYSA-N |
| Molecular Weight | 169.183 g/mol |
| SMILES | C12=CC=C(C=C2C=C(C=C1)O)C#N |
| Spectrum/Structure Validation Score (Vapor Phase IR) | 0.841887 |