| SpectraBase Compound ID | 7GlTypeX3QS |
|---|---|
| InChI | InChI=1S/C16H31NO3/c1-5-13(3)15(18)17-11-9-7-8-10-12-20-16(19)14(4)6-2/h13-14H,5-12H2,1-4H3,(H,17,18) |
| InChIKey | IBYQENBCDPHNRG-UHFFFAOYSA-N |
| Mol Weight | 285.43 g/mol |
| Molecular Formula | C16H31NO3 |
| Exact Mass | 285.230394 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 | JCYvgDET6ZG |
|---|---|
| Name | 6-(2-Methylbutanamido)hexyl 2-methylbutanoate |
| Comments | Computed using HOSE algorithm |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 285.230393859 u |
| Formula | C16H31NO3 |
| InChI | InChI=1S/C16H31NO3/c1-5-13(3)15(18)17-11-9-7-8-10-12-20-16(19)14(4)6-2/h13-14H,5-12H2,1-4H3,(H,17,18) |
| InChIKey | IBYQENBCDPHNRG-UHFFFAOYSA-N |
| SMILES | C(NC(=O)C(CC)C)CCCCCOC(C(CC)C)=O |