| SpectraBase Compound ID | Ft0PPQrKbrF |
|---|---|
| InChI | InChI=1S/C18H32O2/c1-2-3-4-5-6-7-8-9-13-16-20-18(19)17-14-11-10-12-15-17/h2,17H,1,3-16H2 |
| InChIKey | MMRDXNIXMSJGGP-UHFFFAOYSA-N |
| Mol Weight | 280.5 g/mol |
| Molecular Formula | C18H32O2 |
| Exact Mass | 280.24023 g/mol |
Vapor Phase (Gas) Infrared Spectrum
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| SpectraBase Spectrum ID | CfmuJ2aM0GY |
|---|---|
| Name | Cyclohexanecarboxylic acid, undec-10-enyl ester |
| Comments | Computed using SmartSpectra Model v1.42 |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 280.240230268 u |
| Formula | C18H32O2 |
| InChI | InChI=1S/C18H32O2/c1-2-3-4-5-6-7-8-9-13-16-20-18(19)17-14-11-10-12-15-17/h2,17H,1,3-16H2 |
| InChIKey | MMRDXNIXMSJGGP-UHFFFAOYSA-N |
| SMILES | C=CCCCCCCCCCOC(=O)C1CCCCC1 |
| Spectrum/Structure Validation Score (Vapor Phase IR) | 0.967315 |