| SpectraBase Compound ID | 6p2tXTkd91t |
|---|---|
| InChI | InChI=1S/C16H31NO3/c1-4-7-8-9-13-20-16(19)12-10-11-15(18)17-14(5-2)6-3/h14H,4-13H2,1-3H3,(H,17,18) |
| InChIKey | PYLNDCYJIDNGMA-UHFFFAOYSA-N |
| Mol Weight | 285.43 g/mol |
| Molecular Formula | C16H31NO3 |
| Exact Mass | 285.230394 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | D30pNhtL039 |
|---|---|
| Name | Glutaric acid, monoamide, N-(3-pentyl)-, hexyl ester |
| 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/c1-4-7-8-9-13-20-16(19)12-10-11-15(18)17-14(5-2)6-3/h14H,4-13H2,1-3H3,(H,17,18) |
| InChIKey | PYLNDCYJIDNGMA-UHFFFAOYSA-N |
| SMILES | CCC(NC(CCCC(OCCCCCC)=O)=O)CC |