| SpectraBase Compound ID | 1TayfJvBTxv |
|---|---|
| InChI | InChI=1S/C14H29NO/c1-6-8-9-10-14(16)15(11-12(3)4)13(5)7-2/h12-13H,6-11H2,1-5H3 |
| InChIKey | YNLXOGZSPXSZFV-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 | 5QZb5Htxf1G |
|---|---|
| Name | Hexanamide, N-(2-butyl)-N-isobutyl- |
| 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/c1-6-8-9-10-14(16)15(11-12(3)4)13(5)7-2/h12-13H,6-11H2,1-5H3 |
| InChIKey | YNLXOGZSPXSZFV-UHFFFAOYSA-N |
| Molecular Weight | 227.392 g/mol |
| SMILES | C(=O)(N(CC(C)C)C(CC)C)CCCCC |
| Spectrum/Structure Validation Score (Vapor Phase IR) | 0.89822 |