| SpectraBase Compound ID | DlxuUmqmctP |
|---|---|
| InChI | InChI=1S/C14H29NO/c1-6-8-9-11-15(13(5)10-7-2)14(16)12(3)4/h12-13H,6-11H2,1-5H3 |
| InChIKey | FTERKPDHEMWQDR-UHFFFAOYSA-N |
| Mol Weight | 227.39 g/mol |
| Molecular Formula | C14H29NO |
| Exact Mass | 227.224915 g/mol |
Vapor Phase (Gas) Infrared Spectrum
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| SpectraBase Spectrum ID | JVxyuC3nZqr |
|---|---|
| Name | Isobutyramide, N-(2-pentyl)-N-pentyl- |
| Comments | Computed using SmartSpectra Model v1.42 |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 227.224914557 u |
| Formula | C14H29NO |
| InChI | InChI=1S/C14H29NO/c1-6-8-9-11-15(13(5)10-7-2)14(16)12(3)4/h12-13H,6-11H2,1-5H3 |
| InChIKey | FTERKPDHEMWQDR-UHFFFAOYSA-N |
| Molecular Weight | 227.392 g/mol |
| SMILES | C(N(C(CCC)C)C(=O)C(C)C)CCCC |
| Spectrum/Structure Validation Score (Vapor Phase IR) | 0.89302 |