| SpectraBase Compound ID | LFmEXagxrPe |
|---|---|
| InChI | InChI=1S/C11H15NO2/c1-4-14-11(13)12-10-8(2)6-5-7-9(10)3/h5-7H,4H2,1-3H3,(H,12,13) |
| InChIKey | IJAQDOIKWBEHFN-UHFFFAOYSA-N |
| Mol Weight | 193.25 g/mol |
| Molecular Formula | C11H15NO2 |
| Exact Mass | 193.110279 g/mol |
Raman Spectrum
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| SpectraBase Spectrum ID | AZYiPsZHn3o |
|---|---|
| Name | 2,6-Dimethylcarbanilic acid, ethyl ester |
| Comments | Computed using SmartSpectra Model v1.42 |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 193.110278725 u |
| Formula | C11H15NO2 |
| InChI | InChI=1S/C11H15NO2/c1-4-14-11(13)12-10-8(2)6-5-7-9(10)3/h5-7H,4H2,1-3H3,(H,12,13) |
| InChIKey | IJAQDOIKWBEHFN-UHFFFAOYSA-N |
| Molecular Weight | 193.246 g/mol |
| SMILES | N(C1=C(C=CC=C1C)C)C(OCC)=O |
| Spectrum/Structure Validation Score (Raman) | 0.95394 |