| SpectraBase Compound ID | ABNHPJHviKu |
|---|---|
| InChI | InChI=1S/C15H26O4/c1-4-6-7-8-9-12-18-14(16)10-11-15(17)19-13(3)5-2/h10-11,13H,4-9,12H2,1-3H3/b11-10+ |
| InChIKey | ZXLNOSGWXPNTCY-ZHACJKMWSA-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 | 3oZuuZAN3Ys |
|---|---|
| Name | Fumaric acid, 2-butyl heptyl 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/c1-4-6-7-8-9-12-18-14(16)10-11-15(17)19-13(3)5-2/h10-11,13H,4-9,12H2,1-3H3/b11-10+ |
| InChIKey | ZXLNOSGWXPNTCY-ZHACJKMWSA-N |
| Molecular Weight | 270.369 g/mol |
| SMILES | C(\C=C\C(OCCCCCCC)=O)(OC(CC)C)=O |