| SpectraBase Compound ID | 2p0Mr8eBPGQ |
|---|---|
| InChI | InChI=1S/C14H27NO/c1-2-3-4-5-9-12-15-14(16)13-10-7-6-8-11-13/h13H,2-12H2,1H3,(H,15,16) |
| InChIKey | XETUNUIRZSIILW-UHFFFAOYSA-N |
| Mol Weight | 225.38 g/mol |
| Molecular Formula | C14H27NO |
| Exact Mass | 225.209264 g/mol |
Vapor Phase (Gas) Infrared Spectrum
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| SpectraBase Spectrum ID | KlNfNoPnZ5O |
|---|---|
| Name | Cyclohexanecarboxamide, N-heptyl- |
| Comments | Computed using SmartSpectra Model v1.42 |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 225.209264492 u |
| Formula | C14H27NO |
| InChI | InChI=1S/C14H27NO/c1-2-3-4-5-9-12-15-14(16)13-10-7-6-8-11-13/h13H,2-12H2,1H3,(H,15,16) |
| InChIKey | XETUNUIRZSIILW-UHFFFAOYSA-N |
| Molecular Weight | 225.376 g/mol |
| SMILES | C1C(CCCC1)C(NCCCCCCC)=O |
| Spectrum/Structure Validation Score (Vapor Phase IR) | 0.923683 |