| SpectraBase Compound ID | DiqvFkNQ6jI |
|---|---|
| InChI | InChI=1S/C11H21NO2/c1-3-14-11(13)6-8-12-7-4-5-10(2)9-12/h10H,3-9H2,1-2H3 |
| InChIKey | AATMBDYQEPKVEN-UHFFFAOYSA-N |
| Mol Weight | 199.29 g/mol |
| Molecular Formula | C11H21NO2 |
| Exact Mass | 199.157229 g/mol |
Raman Spectrum
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| SpectraBase Spectrum ID | 6A5KPEVLAFl |
|---|---|
| Name | 3-(3-Methyl-1-piperidyl)propionic acid ethyl ester |
| Comments | Computed using SmartSpectra Model v1.42 |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 199.157228918 u |
| Formula | C11H21NO2 |
| InChI | InChI=1S/C11H21NO2/c1-3-14-11(13)6-8-12-7-4-5-10(2)9-12/h10H,3-9H2,1-2H3 |
| InChIKey | AATMBDYQEPKVEN-UHFFFAOYSA-N |
| Molecular Weight | 199.294 g/mol |
| SMILES | C(=O)(CCN1CC(CCC1)C)OCC |
| Spectrum/Structure Validation Score (Raman) | 0.798849 |