| SpectraBase Compound ID | D2sdsBjDcs9 |
|---|---|
| InChI | InChI=1S/C17H32O2/c1-2-3-4-5-6-7-10-15-19-17(18)14-13-16-11-8-9-12-16/h16H,2-15H2,1H3 |
| InChIKey | CBEWPYVMEYHIPC-UHFFFAOYSA-N |
| Mol Weight | 268.4 g/mol |
| Molecular Formula | C17H32O2 |
| Exact Mass | 268.24023 g/mol |
Vapor Phase (Gas) Infrared Spectrum
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| SpectraBase Spectrum ID | K6Nc9GItqpg |
|---|---|
| Name | 3-Cyclopentylpropionic acid, nonyl ester |
| Comments | Computed using SmartSpectra Model v1.42 |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 268.240230268 u |
| Formula | C17H32O2 |
| InChI | InChI=1S/C17H32O2/c1-2-3-4-5-6-7-10-15-19-17(18)14-13-16-11-8-9-12-16/h16H,2-15H2,1H3 |
| InChIKey | CBEWPYVMEYHIPC-UHFFFAOYSA-N |
| SMILES | C(OCCCCCCCCC)(=O)CCC1CCCC1 |
| Spectrum/Structure Validation Score (Vapor Phase IR) | 0.91026 |