| SpectraBase Compound ID | DTBnJ8j1E7R |
|---|---|
| InChI | InChI=1S/C17H35NO2/c1-4-7-9-10-11-13-16-20-17(19)18(14-6-3)15-12-8-5-2/h4-16H2,1-3H3 |
| InChIKey | QSEMPFTVWZJIKJ-UHFFFAOYSA-N |
| Mol Weight | 285.5 g/mol |
| Molecular Formula | C17H35NO2 |
| Exact Mass | 285.266779 g/mol |
Vapor Phase (Gas) Infrared Spectrum
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| SpectraBase Spectrum ID | 8rCfyXal6a5 |
|---|---|
| Name | Carbonic acid, monoamide, N-propyl-N-pentyl-, octyl ester |
| Comments | Computed using SmartSpectra Model v1.42 |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 285.266779369 u |
| Formula | C17H35NO2 |
| InChI | InChI=1S/C17H35NO2/c1-4-7-9-10-11-13-16-20-17(19)18(14-6-3)15-12-8-5-2/h4-16H2,1-3H3 |
| InChIKey | QSEMPFTVWZJIKJ-UHFFFAOYSA-N |
| SMILES | C(=O)(OCCCCCCCC)N(CCC)CCCCC |
| Spectrum/Structure Validation Score (Vapor Phase IR) | 0.938514 |