| SpectraBase Compound ID | LuowDT08twS |
|---|---|
| InChI | InChI=1S/C11H14O3/c1-3-13-10-7-5-9(6-8-10)11(12)14-4-2/h5-8H,3-4H2,1-2H3 |
| InChIKey | HRAQMGWTPNOILP-UHFFFAOYSA-N |
| Mol Weight | 194.23 g/mol |
| Molecular Formula | C11H14O3 |
| Exact Mass | 194.094294 g/mol |
Raman Spectrum
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| SpectraBase Spectrum ID | KjwHqBxApKb |
|---|---|
| Name | p-Ethoxybenzoic acid, ethyl ester |
| Comments | Computed using SmartSpectra Model v1.42 |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 194.094294308 u |
| Formula | C11H14O3 |
| InChI | InChI=1S/C11H14O3/c1-3-13-10-7-5-9(6-8-10)11(12)14-4-2/h5-8H,3-4H2,1-2H3 |
| InChIKey | HRAQMGWTPNOILP-UHFFFAOYSA-N |
| Molecular Weight | 194.230 g/mol |
| SMILES | C=1C(=CC=C(C1)OCC)C(OCC)=O |
| Spectrum/Structure Validation Score (Raman) | 0.99361 |