| SpectraBase Compound ID | 52nY1Q73VfN |
|---|---|
| InChI | InChI=1S/C10H13NO2/c1-3-13-10(12)11-9-7-5-4-6-8(9)2/h4-7H,3H2,1-2H3,(H,11,12) |
| InChIKey | KXOFYXSXZGSQED-UHFFFAOYSA-N |
| Mol Weight | 179.22 g/mol |
| Molecular Formula | C10H13NO2 |
| Exact Mass | 179.094629 g/mol |
Raman Spectrum
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| SpectraBase Spectrum ID | BYKu4zKq5ad |
|---|---|
| Name | o-Methylcarbanilic acid, ethyl ester |
| Comments | Computed using SmartSpectra Model v1.42 |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 179.094628661 u |
| Formula | C10H13NO2 |
| InChI | InChI=1S/C10H13NO2/c1-3-13-10(12)11-9-7-5-4-6-8(9)2/h4-7H,3H2,1-2H3,(H,11,12) |
| InChIKey | KXOFYXSXZGSQED-UHFFFAOYSA-N |
| SMILES | N(C1=CC=CC=C1C)C(OCC)=O |
| Spectrum/Structure Validation Score (Raman) | 0.903474 |