| SpectraBase Compound ID | GQcMtft4rLj |
|---|---|
| InChI | InChI=1S/C17H31NO3/c1-15(2)9-8-14-21-17(20)11-5-4-10-16(19)18-12-6-3-7-13-18/h15H,3-14H2,1-2H3 |
| InChIKey | BFVAVHYRVYZUCU-UHFFFAOYSA-N |
| Mol Weight | 297.44 g/mol |
| Molecular Formula | C17H31NO3 |
| Exact Mass | 297.230394 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | 7j7EScIewo0 |
|---|---|
| Name | Adipic acid, monopiperidide, isohexyl ester |
| Comments | Computed using HOSE algorithm |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 297.230393859 u |
| Formula | C17H31NO3 |
| InChI | InChI=1S/C17H31NO3/c1-15(2)9-8-14-21-17(20)11-5-4-10-16(19)18-12-6-3-7-13-18/h15H,3-14H2,1-2H3 |
| InChIKey | BFVAVHYRVYZUCU-UHFFFAOYSA-N |
| SMILES | C(C(=O)N1CCCCC1)CCCC(OCCCC(C)C)=O |