| SpectraBase Compound ID | J01o8kJssLU |
|---|---|
| InChI | InChI=1S/C16H33NO/c1-4-7-9-10-11-13-16(18)17-14-15(6-3)12-8-5-2/h15H,4-14H2,1-3H3,(H,17,18) |
| InChIKey | PHSSNJHDKDYUDW-UHFFFAOYSA-N |
| Mol Weight | 255.4 g/mol |
| Molecular Formula | C16H33NO |
| Exact Mass | 255.256215 g/mol |
Vapor Phase (Gas) Infrared Spectrum
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| SpectraBase Spectrum ID | 4tLr2ww86Cl |
|---|---|
| Name | Octanamide, N-2-ethylhexyl- |
| Comments | Computed using SmartSpectra Model v1.42 |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 255.256214686 u |
| Formula | C16H33NO |
| InChI | InChI=1S/C16H33NO/c1-4-7-9-10-11-13-16(18)17-14-15(6-3)12-8-5-2/h15H,4-14H2,1-3H3,(H,17,18) |
| InChIKey | PHSSNJHDKDYUDW-UHFFFAOYSA-N |
| Molecular Weight | 255.446 g/mol |
| SMILES | C(CCCCCCC)(NCC(CCCC)CC)=O |
| Spectrum/Structure Validation Score (Vapor Phase IR) | 0.914692 |