| SpectraBase Compound ID | IHaYpyNV3yr |
|---|---|
| InChI | InChI=1S/C16H31NO4/c1-3-5-6-7-11-14-21-15(18)12-9-8-10-13-17-16(19)20-4-2/h3-14H2,1-2H3,(H,17,19) |
| InChIKey | VNMZZYAGFKBMSF-UHFFFAOYSA-N |
| Mol Weight | 301.43 g/mol |
| Molecular Formula | C16H31NO4 |
| Exact Mass | 301.225308 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
View the Full Spectrum for FREE!
The full spectrum can only be viewed using a FREE account.
| SpectraBase Spectrum ID | CYMciAPZsdU |
|---|---|
| Name | 6-Aminocaproic acid, N-ethoxycarbonyl-, heptyl ester |
| Comments | Computed using HOSE algorithm |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 301.225308478 u |
| Formula | C16H31NO4 |
| InChI | InChI=1S/C16H31NO4/c1-3-5-6-7-11-14-21-15(18)12-9-8-10-13-17-16(19)20-4-2/h3-14H2,1-2H3,(H,17,19) |
| InChIKey | VNMZZYAGFKBMSF-UHFFFAOYSA-N |
| SMILES | CCOC(NCCCCCC(OCCCCCCC)=O)=O |