| SpectraBase Compound ID | 7BZ4i1AgT0X |
|---|---|
| InChI | InChI=1S/C16H30O5/c1-3-4-5-6-9-12-20-15(17)10-7-8-11-16(18)21-14-13-19-2/h3-14H2,1-2H3 |
| InChIKey | CPHNUYAXFHDUFV-UHFFFAOYSA-N |
| Mol Weight | 302.41 g/mol |
| Molecular Formula | C16H30O5 |
| Exact Mass | 302.209324 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | 7XZm57uXCfS |
|---|---|
| Name | Adipic acid, heptyl 2-methoxyethyl ester |
| Comments | Computed using HOSE algorithm |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 302.209324061 u |
| Formula | C16H30O5 |
| InChI | InChI=1S/C16H30O5/c1-3-4-5-6-9-12-20-15(17)10-7-8-11-16(18)21-14-13-19-2/h3-14H2,1-2H3 |
| InChIKey | CPHNUYAXFHDUFV-UHFFFAOYSA-N |
| SMILES | C(CC(=O)OCCOC)CCC(OCCCCCCC)=O |