| SpectraBase Compound ID | ChoxdQO3si3 |
|---|---|
| InChI | InChI=1S/C11H23NO/c1-4-6-7-9-12-11(13)10(3)8-5-2/h10H,4-9H2,1-3H3,(H,12,13) |
| InChIKey | GGVYGQXJIDIPAU-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 | LORQL89R0rG |
|---|---|
| Name | Valeramide, 2-methyl-N-pentyl- |
| 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/c1-4-6-7-9-12-11(13)10(3)8-5-2/h10H,4-9H2,1-3H3,(H,12,13) |
| InChIKey | GGVYGQXJIDIPAU-UHFFFAOYSA-N |
| Molecular Weight | 185.311 g/mol |
| SMILES | C(=O)(NCCCCC)C(CCC)C |
| Spectrum/Structure Validation Score (Vapor Phase IR) | 0.816798 |