| SpectraBase Compound ID | 5ZGQPgDYXXG |
|---|---|
| InChI | InChI=1S/C15H27NO4/c1-4-5-6-7-8-12-19-14(17)9-10-15(18)20-13-11-16(2)3/h9-10H,4-8,11-13H2,1-3H3/b10-9+ |
| InChIKey | ASMPZXPCOAGAJC-MDZDMXLPSA-N |
| Mol Weight | 285.38 g/mol |
| Molecular Formula | C15H27NO4 |
| Exact Mass | 285.194008 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | BW0h2wWR3zN |
|---|---|
| Name | Fumaric acid, 2-dimethylaminoethyl heptyl ester |
| Comments | Computed using HOSE algorithm |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 285.194008349 u |
| Formula | C15H27NO4 |
| InChI | InChI=1S/C15H27NO4/c1-4-5-6-7-8-12-19-14(17)9-10-15(18)20-13-11-16(2)3/h9-10H,4-8,11-13H2,1-3H3/b10-9+ |
| InChIKey | ASMPZXPCOAGAJC-MDZDMXLPSA-N |
| SMILES | C(OC(\C=C\C(OCCN(C)C)=O)=O)CCCCCC |