| SpectraBase Compound ID | GQaNRw9tOfZ |
|---|---|
| InChI | InChI=1S/C13H19NO/c1-2-3-11-14-13(15)10-9-12-7-5-4-6-8-12/h4-5,12H,2-3,6-8,11H2,1H3,(H,14,15) |
| InChIKey | LRYOOFFDZDVJST-UHFFFAOYSA-N |
| Mol Weight | 205.3 g/mol |
| Molecular Formula | C13H19NO |
| Exact Mass | 205.146664 g/mol |
Vapor Phase (Gas) Infrared Spectrum
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| SpectraBase Spectrum ID | E7CsA6vJ9fJ |
|---|---|
| Name | N-(N-Butyl)-3-cyclohexenylpropiolamide |
| Comments | Computed using SmartSpectra Model v1.42 |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 205.146664235 u |
| Formula | C13H19NO |
| InChI | InChI=1S/C13H19NO/c1-2-3-11-14-13(15)10-9-12-7-5-4-6-8-12/h4-5,12H,2-3,6-8,11H2,1H3,(H,14,15) |
| InChIKey | LRYOOFFDZDVJST-UHFFFAOYSA-N |
| Molecular Weight | 205.301 g/mol |
| SMILES | C(#CC1CC=CCC1)C(=O)NCCCC |
| Spectrum/Structure Validation Score (Vapor Phase IR) | 0.889476 |