| SpectraBase Compound ID | 8AE5PNMMJdh |
|---|---|
| InChI | InChI=1S/C18H35NO/c1-4-7-9-11-12-14-17-19(16-6-3)18(20)15-13-10-8-5-2/h8,10H,4-7,9,11-17H2,1-3H3/b10-8+ |
| InChIKey | PJGWYJVONCRYDV-CSKARUKUSA-N |
| Mol Weight | 281.5 g/mol |
| Molecular Formula | C18H35NO |
| Exact Mass | 281.271865 g/mol |
Vapor Phase (Gas) Infrared Spectrum
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| SpectraBase Spectrum ID | 5I9FAogilZ3 |
|---|---|
| Name | Hept-4-enoylamide, N-propyl-N-octyl- |
| Comments | Computed using SmartSpectra Model v1.42 |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 281.271864750 u |
| Formula | C18H35NO |
| InChI | InChI=1S/C18H35NO/c1-4-7-9-11-12-14-17-19(16-6-3)18(20)15-13-10-8-5-2/h8,10H,4-7,9,11-17H2,1-3H3/b10-8+ |
| InChIKey | PJGWYJVONCRYDV-CSKARUKUSA-N |
| SMILES | C(\C=C\CCC(N(CCCCCCCC)CCC)=O)C |
| Spectrum/Structure Validation Score (Vapor Phase IR) | 0.974367 |