| SpectraBase Compound ID | JjadCPxDY1i |
|---|---|
| InChI | InChI=1S/C8H15NO/c1-2-8(10)7-9-5-3-4-6-9/h2-7H2,1H3 |
| InChIKey | FKJHJSJBXISMIR-UHFFFAOYSA-N |
| Mol Weight | 141.21 g/mol |
| Molecular Formula | C8H15NO |
| Exact Mass | 141.115364 g/mol |
Vapor Phase (Gas) Infrared Spectrum
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| SpectraBase Spectrum ID | 1lP08G1fTHO |
|---|---|
| Name | 1-(1'-Pyrrolidinyl)-2-butanone |
| Comments | Computed using SmartSpectra Model v1.42 |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 141.115364106 u |
| Formula | C8H15NO |
| InChI | InChI=1S/C8H15NO/c1-2-8(10)7-9-5-3-4-6-9/h2-7H2,1H3 |
| InChIKey | FKJHJSJBXISMIR-UHFFFAOYSA-N |
| Molecular Weight | 141.214 g/mol |
| SMILES | C1CCN(C1)CC(=O)CC |
| Spectrum/Structure Validation Score (Vapor Phase IR) | 0.954078 |