| SpectraBase Compound ID | 7ZPmdPj9pyM |
|---|---|
| InChI | InChI=1S/C14H13NO/c1-11-7-9-12(10-8-11)14(16)15-13-5-3-2-4-6-13/h2-10H,1H3,(H,15,16) |
| InChIKey | PQEOPHYIUYAVDQ-UHFFFAOYSA-N |
| Mol Weight | 211.26 g/mol |
| Molecular Formula | C14H13NO |
| Exact Mass | 211.099714 g/mol |
| SpectraBase Spectrum ID | HP174cjFf1F |
|---|---|
| Name | p-Toluanilide |
| Comments | Computed using SmartSpectra Model v1.42 |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 211.099714042 u |
| Formula | C14H13NO |
| InChI | InChI=1S/C14H13NO/c1-11-7-9-12(10-8-11)14(16)15-13-5-3-2-4-6-13/h2-10H,1H3,(H,15,16) |
| InChIKey | PQEOPHYIUYAVDQ-UHFFFAOYSA-N |
| Molecular Weight | 211.264 g/mol |
| SMILES | N(C(C1=CC=C(C=C1)C)=O)C=1C=CC=CC1 |
| Spectrum/Structure Validation Score (Raman) | 0.904194 |