| SpectraBase Compound ID | FTmWj2TlpOn |
|---|---|
| InChI | InChI=1S/C11H21NO2/c1-11(2,9-10(13)14-3)12-7-5-4-6-8-12/h4-9H2,1-3H3 |
| InChIKey | VSAWBBMBXRCABA-UHFFFAOYSA-N |
| Mol Weight | 199.29 g/mol |
| Molecular Formula | C11H21NO2 |
| Exact Mass | 199.157229 g/mol |
Vapor Phase (Gas) Infrared Spectrum
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| SpectraBase Spectrum ID | B24ABf6F9yG |
|---|---|
| Name | Methyl 3-methyl-3-piperidin-1-ylbutanoate |
| 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/c1-11(2,9-10(13)14-3)12-7-5-4-6-8-12/h4-9H2,1-3H3 |
| InChIKey | VSAWBBMBXRCABA-UHFFFAOYSA-N |
| Molecular Weight | 199.294 g/mol |
| SMILES | C(CC(=O)OC)(N1CCCCC1)(C)C |
| Spectrum/Structure Validation Score (Vapor Phase IR) | 0.942805 |