| SpectraBase Compound ID | AM35hTVlE1P |
|---|---|
| InChI | InChI=1S/C11H15NO2/c1-3-8(2)14-11(13)9-4-6-10(12)7-5-9/h4-8H,3,12H2,1-2H3 |
| InChIKey | ROVCSQPVIUUCRI-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 | 8mzOEgmG7ad |
|---|---|
| Name | Benzoic acid, 4-amino-, 1-methylpropyl 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/c1-3-8(2)14-11(13)9-4-6-10(12)7-5-9/h4-8H,3,12H2,1-2H3 |
| InChIKey | ROVCSQPVIUUCRI-UHFFFAOYSA-N |
| Molecular Weight | 193.246 g/mol |
| SMILES | C1=CC(=CC=C1C(OC(CC)C)=O)N |
| Spectrum/Structure Validation Score (Vapor Phase IR) | 0.914397 |