| SpectraBase Compound ID | 6gfcQYnEXjs |
|---|---|
| InChI | InChI=1S/C12H13NO/c1-2-3-5-10-12(14)13-11-8-6-4-7-9-11/h2-10H,1H3,(H,13,14)/b3-2+,10-5+ |
| InChIKey | CTUGPZWRPKLTPL-XPQLPGEHSA-N |
| Mol Weight | 187.24 g/mol |
| Molecular Formula | C12H13NO |
| Exact Mass | 187.099714 g/mol |
Raman Spectrum
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| SpectraBase Spectrum ID | IuOv0NzkcjI |
|---|---|
| Name | Sorbanilide |
| Comments | Computed using SmartSpectra Model v1.42 |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 187.099714042 u |
| Formula | C12H13NO |
| InChI | InChI=1S/C12H13NO/c1-2-3-5-10-12(14)13-11-8-6-4-7-9-11/h2-10H,1H3,(H,13,14)/b3-2+,10-5+ |
| InChIKey | CTUGPZWRPKLTPL-XPQLPGEHSA-N |
| Molecular Weight | 187.242 g/mol |
| SMILES | N(C1=CC=CC=C1)C(=O)\C=C\C=C\C |
| Spectrum/Structure Validation Score (Raman) | 0.908384 |