| SpectraBase Compound ID | 28hG8jGAfRK |
|---|---|
| InChI | InChI=1S/C11H23NO/c1-6-8-10(5)12(7-2)11(13)9(3)4/h9-10H,6-8H2,1-5H3 |
| InChIKey | VQNFZUDLRGNAGD-UHFFFAOYSA-N |
| Mol Weight | 185.31 g/mol |
| Molecular Formula | C11H23NO |
| Exact Mass | 185.177964 g/mol |
Vapor Phase (Gas) Infrared Spectrum
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| SpectraBase Spectrum ID | 2aXmpEFZqMw |
|---|---|
| Name | Isobutyramide, N-(2-pentyl)-N-ethyl- |
| Comments | Computed using SmartSpectra Model v1.42 |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 185.177964364 u |
| Formula | C11H23NO |
| InChI | InChI=1S/C11H23NO/c1-6-8-10(5)12(7-2)11(13)9(3)4/h9-10H,6-8H2,1-5H3 |
| InChIKey | VQNFZUDLRGNAGD-UHFFFAOYSA-N |
| Molecular Weight | 185.311 g/mol |
| SMILES | C(N(C(CCC)C)C(=O)C(C)C)C |
| Spectrum/Structure Validation Score (Vapor Phase IR) | 0.957323 |