| SpectraBase Compound ID | 3SlDKGTTuGt |
|---|---|
| InChI | InChI=1S/C20H39NO3/c1-3-5-7-9-10-12-14-18-24-20(23)16-17-21-19(22)15-13-11-8-6-4-2/h3-18H2,1-2H3,(H,21,22) |
| InChIKey | JKHDYLJCIZHMEW-UHFFFAOYSA-N |
| Mol Weight | 341.5 g/mol |
| Molecular Formula | C20H39NO3 |
| Exact Mass | 341.292994 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 | IEzQ6a8Lmao |
|---|---|
| Name | .beta.-Alanine, N-capryloyl-, nonyl 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/c1-3-5-7-9-10-12-14-18-24-20(23)16-17-21-19(22)15-13-11-8-6-4-2/h3-18H2,1-2H3,(H,21,22) |
| InChIKey | JKHDYLJCIZHMEW-UHFFFAOYSA-N |
| Molecular Weight | 341.536 g/mol |
| SMILES | CCCCCCCC(NCCC(OCCCCCCCCC)=O)=O |