| SpectraBase Compound ID | fuwVi6umfN |
|---|---|
| InChI | InChI=1S/C11H21NO/c1-2-3-4-5-8-11(13)12-9-6-7-10-12/h2-10H2,1H3 |
| InChIKey | QVOSVLZUDHBRQW-UHFFFAOYSA-N |
| Mol Weight | 183.29 g/mol |
| Molecular Formula | C11H21NO |
| Exact Mass | 183.162314 g/mol |
Vapor Phase (Gas) Infrared Spectrum
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| SpectraBase Spectrum ID | KfCQva9aklM |
|---|---|
| Name | 1-(Pyrrolidin-1-yl)heptan-1-one |
| Comments | Computed using SmartSpectra Model v1.42 |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 183.162314299 u |
| Formula | C11H21NO |
| InChI | InChI=1S/C11H21NO/c1-2-3-4-5-8-11(13)12-9-6-7-10-12/h2-10H2,1H3 |
| InChIKey | QVOSVLZUDHBRQW-UHFFFAOYSA-N |
| Molecular Weight | 183.295 g/mol |
| SMILES | C(N1CCCC1)(CCCCCC)=O |
| Spectrum/Structure Validation Score (Vapor Phase IR) | 0.96833 |