| SpectraBase Compound ID | BvbBtZRGfkr |
|---|---|
| InChI | InChI=1S/C15H26O4/c1-5-6-7-10-18-14(16)8-9-15(17)19-13(4)11-12(2)3/h8-9,12-13H,5-7,10-11H2,1-4H3/b9-8+ |
| InChIKey | JEQDKYZBZYZQBC-CMDGGOBGSA-N |
| Mol Weight | 270.37 g/mol |
| Molecular Formula | C15H26O4 |
| Exact Mass | 270.183109 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | A5SK8tn4ZVh |
|---|---|
| Name | Fumaric acid, 4-methylpent-2-yl pentyl ester |
| Comments | Computed using HOSE algorithm |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 270.183109313 u |
| Formula | C15H26O4 |
| InChI | InChI=1S/C15H26O4/c1-5-6-7-10-18-14(16)8-9-15(17)19-13(4)11-12(2)3/h8-9,12-13H,5-7,10-11H2,1-4H3/b9-8+ |
| InChIKey | JEQDKYZBZYZQBC-CMDGGOBGSA-N |
| Molecular Weight | 270.369 g/mol |
| SMILES | C(OC(C)CC(C)C)(\C=C\C(OCCCCC)=O)=O |