| SpectraBase Compound ID | HhWUzMbHnLL |
|---|---|
| InChI | InChI=1S/C19H35NO3/c1-3-5-7-8-9-10-11-12-13-16-20-18(21)14-15-19(22)23-17-6-4-2/h14-15H,3-13,16-17H2,1-2H3,(H,20,21)/b15-14+ |
| InChIKey | KSESQJAXRGAHNL-CCEZHUSRSA-N |
| Mol Weight | 325.5 g/mol |
| Molecular Formula | C19H35NO3 |
| Exact Mass | 325.261694 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | 3Re5hwGntc3 |
|---|---|
| Name | Fumaric acid, monoamide, N-undecyl-, butyl ester |
| Comments | Computed using HOSE algorithm |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 325.261693988 u |
| Formula | C19H35NO3 |
| InChI | InChI=1S/C19H35NO3/c1-3-5-7-8-9-10-11-12-13-16-20-18(21)14-15-19(22)23-17-6-4-2/h14-15H,3-13,16-17H2,1-2H3,(H,20,21)/b15-14+ |
| InChIKey | KSESQJAXRGAHNL-CCEZHUSRSA-N |
| Molecular Weight | 325.493 g/mol |
| SMILES | C(CNC(\C=C\C(OCCCC)=O)=O)CCCCCCCCC |