| SpectraBase Compound ID | JSxJtqMLO6g |
|---|---|
| InChI | InChI=1S/C9H10N2O/c1-12-9-5-3-2-4-8(9)11-7-6-10/h2-5,11H,7H2,1H3 |
| InChIKey | YLHGOLRGUDDMDW-UHFFFAOYSA-N |
| Mol Weight | 162.19 g/mol |
| Molecular Formula | C9H10N2O |
| Exact Mass | 162.079313 g/mol |
Raman Spectrum
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| SpectraBase Spectrum ID | A6YRwgRGzCV |
|---|---|
| Name | (o-Anisidino)acetonitrile |
| Comments | Computed using SmartSpectra Model v1.42 |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 162.079312949 u |
| Formula | C9H10N2O |
| InChI | InChI=1S/C9H10N2O/c1-12-9-5-3-2-4-8(9)11-7-6-10/h2-5,11H,7H2,1H3 |
| InChIKey | YLHGOLRGUDDMDW-UHFFFAOYSA-N |
| SMILES | N(C1=CC=CC=C1OC)CC#N |
| Spectrum/Structure Validation Score (Raman) | 0.967605 |