| SpectraBase Compound ID | 7M6Gkyih6cX |
|---|---|
| InChI | InChI=1S/C18H35NO/c1-3-5-7-9-10-11-13-15-17-19-18(20)16-14-12-8-6-4-2/h12,14H,3-11,13,15-17H2,1-2H3,(H,19,20)/b14-12+ |
| InChIKey | QYZVISZCXMJDRO-WYMLVPIESA-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 | 2tCrMozkppY |
|---|---|
| Name | oct-3-Enoylamide, N-decyl- |
| 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/c1-3-5-7-9-10-11-13-15-17-19-18(20)16-14-12-8-6-4-2/h12,14H,3-11,13,15-17H2,1-2H3,(H,19,20)/b14-12+ |
| InChIKey | QYZVISZCXMJDRO-WYMLVPIESA-N |
| SMILES | C(NCCCCCCCCCC)(=O)C\C=C\CCCC |
| Spectrum/Structure Validation Score (Vapor Phase IR) | 0.977528 |