| SpectraBase Compound ID | 9yUJsP1uQQ9 |
|---|---|
| InChI | InChI=1S/C15H28O4/c1-3-5-9-13-19-15(17)11-8-6-7-10-14(16)18-12-4-2/h3-13H2,1-2H3 |
| InChIKey | QDWVFMZVHAKGIA-UHFFFAOYSA-N |
| Mol Weight | 272.38 g/mol |
| Molecular Formula | C15H28O4 |
| Exact Mass | 272.198759 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | 9tbBvYQfbCj |
|---|---|
| Name | Pimelic acid, propyl pentyl ester |
| Comments | Computed using HOSE algorithm |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 272.198759378 u |
| Formula | C15H28O4 |
| InChI | InChI=1S/C15H28O4/c1-3-5-9-13-19-15(17)11-8-6-7-10-14(16)18-12-4-2/h3-13H2,1-2H3 |
| InChIKey | QDWVFMZVHAKGIA-UHFFFAOYSA-N |
| SMILES | C(OCCCCC)(=O)CCCCCC(OCCC)=O |