| SpectraBase Compound ID | 9URkOsEREj7 |
|---|---|
| InChI | InChI=1S/C17H32O2/c1-2-3-4-5-6-7-8-9-10-11-12-13-14-15-16-17(18)19/h2-3H,4-16H2,1H3,(H,18,19)/b3-2+ |
| InChIKey | QCIGIZBRIXIGRF-NSCUHMNNSA-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 | BIANr7CiEgy |
|---|---|
| Name | E-15-Heptadecenoic acid |
| 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/c1-2-3-4-5-6-7-8-9-10-11-12-13-14-15-16-17(18)19/h2-3H,4-16H2,1H3,(H,18,19)/b3-2+ |
| InChIKey | QCIGIZBRIXIGRF-NSCUHMNNSA-N |
| SMILES | C(CCCCCCCCCCCCC(=O)O)\C=C\C |
| Spectrum/Structure Validation Score (Vapor Phase IR) | 0.968834 |