| SpectraBase Compound ID | 94muQhd7gPS |
|---|---|
| InChI | InChI=1S/C12H23NO/c1-4-11(5-2)12(14)13-9-7-6-8-10(13)3/h10-11H,4-9H2,1-3H3 |
| InChIKey | VLYXJVOQOKXYHC-UHFFFAOYSA-N |
| Mol Weight | 197.32 g/mol |
| Molecular Formula | C12H23NO |
| Exact Mass | 197.177964 g/mol |
Vapor Phase (Gas) Infrared Spectrum
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| SpectraBase Spectrum ID | 9kHSyG8ZENV |
|---|---|
| Name | (+/-)-1-(2-ethylbutanoyl)-2-methylpiperidine |
| Comments | Computed using SmartSpectra Model v1.42 |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 197.177964364 u |
| Formula | C12H23NO |
| InChI | InChI=1S/C12H23NO/c1-4-11(5-2)12(14)13-9-7-6-8-10(13)3/h10-11H,4-9H2,1-3H3 |
| InChIKey | VLYXJVOQOKXYHC-UHFFFAOYSA-N |
| Molecular Weight | 197.322 g/mol |
| SMILES | C(C(N1C(CCCC1)C)=O)(CC)CC |
| Spectrum/Structure Validation Score (Vapor Phase IR) | 0.918412 |