| SpectraBase Compound ID | 7nafPeXagEK |
|---|---|
| InChI | InChI=1S/C15H24O4/c1-2-3-11-18-14(16)9-10-15(17)19-12-13-7-5-4-6-8-13/h9-10,13H,2-8,11-12H2,1H3/b10-9+ |
| InChIKey | ZVQYUFGBIDNLDZ-MDZDMXLPSA-N |
| Mol Weight | 268.35 g/mol |
| Molecular Formula | C15H24O4 |
| Exact Mass | 268.167459 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | DLVQ7tbvXC6 |
|---|---|
| Name | Fumaric acid, butyl cyclohexylmethyl ester |
| Comments | Computed using HOSE algorithm |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 268.167459249 u |
| Formula | C15H24O4 |
| InChI | InChI=1S/C15H24O4/c1-2-3-11-18-14(16)9-10-15(17)19-12-13-7-5-4-6-8-13/h9-10,13H,2-8,11-12H2,1H3/b10-9+ |
| InChIKey | ZVQYUFGBIDNLDZ-MDZDMXLPSA-N |
| Molecular Weight | 268.353 g/mol |
| SMILES | C1(CCCCC1)COC(\C=C\C(OCCCC)=O)=O |