| SpectraBase Compound ID | 5ptPZQ80dND |
|---|---|
| InChI | InChI=1S/C11H15NO2/c1-3-12-10-7-5-9(6-8-10)11(13)14-4-2/h5-8,12H,3-4H2,1-2H3 |
| InChIKey | GDIMKVMLVSCQJB-UHFFFAOYSA-N |
| Mol Weight | 193.25 g/mol |
| Molecular Formula | C11H15NO2 |
| Exact Mass | 193.110279 g/mol |
Vapor Phase (Gas) Infrared Spectrum
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| SpectraBase Spectrum ID | GsqT1T4rH5A |
|---|---|
| Name | Benzoic acid, 4-ethylamino-, 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/c1-3-12-10-7-5-9(6-8-10)11(13)14-4-2/h5-8,12H,3-4H2,1-2H3 |
| InChIKey | GDIMKVMLVSCQJB-UHFFFAOYSA-N |
| Molecular Weight | 193.246 g/mol |
| SMILES | C1=CC(=CC=C1C(OCC)=O)NCC |
| Spectrum/Structure Validation Score (Vapor Phase IR) | 0.937353 |