| SpectraBase Compound ID | 7eoOoWfwwUj |
|---|---|
| InChI | InChI=1S/C20H39NO3/c1-4-7-9-13-17-21(18-14-10-8-5-2)19(22)15-11-12-16-20(23)24-6-3/h4-18H2,1-3H3 |
| InChIKey | LTLBYZBUSKHVBF-UHFFFAOYSA-N |
| Mol Weight | 341.5 g/mol |
| Molecular Formula | C20H39NO3 |
| Exact Mass | 341.292994 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | HqFKcmY32QP |
|---|---|
| Name | Adipic acid, monoamide, N,N-dihexyl, ethyl ester |
| Comments | Computed using HOSE algorithm |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 341.292994117 u |
| Formula | C20H39NO3 |
| InChI | InChI=1S/C20H39NO3/c1-4-7-9-13-17-21(18-14-10-8-5-2)19(22)15-11-12-16-20(23)24-6-3/h4-18H2,1-3H3 |
| InChIKey | LTLBYZBUSKHVBF-UHFFFAOYSA-N |
| Molecular Weight | 341.536 g/mol |
| SMILES | C(CCC(=O)N(CCCCCC)CCCCCC)CC(OCC)=O |