| SpectraBase Compound ID | TOBnHvLhVT |
|---|---|
| InChI | InChI=1S/C14H29NO/c1-3-5-7-8-9-10-11-13-15-14(16)12-6-4-2/h3-13H2,1-2H3,(H,15,16) |
| InChIKey | GOMQAPPROMGMME-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 | 1BpNOrC55Kq |
|---|---|
| Name | Valeramide, N-nonyl- |
| 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/c1-3-5-7-8-9-10-11-13-15-14(16)12-6-4-2/h3-13H2,1-2H3,(H,15,16) |
| InChIKey | GOMQAPPROMGMME-UHFFFAOYSA-N |
| Molecular Weight | 227.392 g/mol |
| SMILES | CCCCC(NCCCCCCCCC)=O |
| Spectrum/Structure Validation Score (Vapor Phase IR) | 0.927113 |