| SpectraBase Compound ID | 4eqMfnP2Vrf |
|---|---|
| InChI | InChI=1S/C13H27NO/c1-3-5-7-9-11-13(15)14-12-10-8-6-4-2/h3-12H2,1-2H3,(H,14,15) |
| InChIKey | CYWUZSYXTCCCRG-UHFFFAOYSA-N |
| Mol Weight | 213.36 g/mol |
| Molecular Formula | C13H27NO |
| Exact Mass | 213.209264 g/mol |
Vapor Phase (Gas) Infrared Spectrum
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| SpectraBase Spectrum ID | LHD7qHvGgh5 |
|---|---|
| Name | N-Hexylenanthamide |
| Comments | Computed using SmartSpectra Model v1.42 |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 213.209264492 u |
| Formula | C13H27NO |
| InChI | InChI=1S/C13H27NO/c1-3-5-7-9-11-13(15)14-12-10-8-6-4-2/h3-12H2,1-2H3,(H,14,15) |
| InChIKey | CYWUZSYXTCCCRG-UHFFFAOYSA-N |
| Molecular Weight | 213.365 g/mol |
| SMILES | C(=O)(NCCCCCC)CCCCCC |
| Spectrum/Structure Validation Score (Vapor Phase IR) | 0.918124 |