| SpectraBase Compound ID | 1N2lv2aYl3K |
|---|---|
| InChI | InChI=1S/C18H25NO3/c1-3-5-6-7-14-22-18(21)13-12-17(20)19-16-10-8-15(4-2)9-11-16/h8-13H,3-7,14H2,1-2H3,(H,19,20)/b13-12+ |
| InChIKey | NLWNUEOJWWHJEE-OUKQBFOZSA-N |
| Mol Weight | 303.4 g/mol |
| Molecular Formula | C18H25NO3 |
| Exact Mass | 303.183444 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | DJP4EPBuBu8 |
|---|---|
| Name | Fumaric acid, monoamide, N-(4-ethylphenyl)-, hexyl ester |
| Comments | Computed using HOSE algorithm |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 303.183443666 u |
| Formula | C18H25NO3 |
| InChI | InChI=1S/C18H25NO3/c1-3-5-6-7-14-22-18(21)13-12-17(20)19-16-10-8-15(4-2)9-11-16/h8-13H,3-7,14H2,1-2H3,(H,19,20)/b13-12+ |
| InChIKey | NLWNUEOJWWHJEE-OUKQBFOZSA-N |
| Molecular Weight | 303.402 g/mol |
| SMILES | C1=C(C=CC(=C1)CC)NC(\C=C\C(OCCCCCC)=O)=O |