| SpectraBase Compound ID | 8ED7oPP4HIJ |
|---|---|
| InChI | InChI=1S/C18H34O3/c1-2-3-4-5-6-7-8-9-10-11-14-17(19)15-12-13-16-18(20)21/h2-16H2,1H3,(H,20,21) |
| InChIKey | QZLYZQUYIQGGOQ-UHFFFAOYSA-N |
| Mol Weight | 298.5 g/mol |
| Molecular Formula | C18H34O3 |
| Exact Mass | 298.250795 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | BvheUEvJwzh |
|---|---|
| Name | 6-oxo-Octadecanoic acid |
| Comments | Computed using HOSE algorithm |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 298.250794952 u |
| Formula | C18H34O3 |
| InChI | InChI=1S/C18H34O3/c1-2-3-4-5-6-7-8-9-10-11-14-17(19)15-12-13-16-18(20)21/h2-16H2,1H3,(H,20,21) |
| InChIKey | QZLYZQUYIQGGOQ-UHFFFAOYSA-N |
| SMILES | C(CCCCC(CCCCCCCCCCCC)=O)(=O)O |