| SpectraBase Compound ID | pCkQRBI3NQ |
|---|---|
| InChI | InChI=1S/C16H30O6/c1-19-11-13-21-15(17)9-7-5-3-4-6-8-10-16(18)22-14-12-20-2/h3-14H2,1-2H3 |
| InChIKey | JGDURTCBAJOZDJ-UHFFFAOYSA-N |
| Mol Weight | 318.41 g/mol |
| Molecular Formula | C16H30O6 |
| Exact Mass | 318.204239 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | AY4MV8mKGWC |
|---|---|
| Name | Sebacic acid, di(2-methoxyethyl) ester |
| Comments | Computed using HOSE algorithm |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 318.204238680 u |
| Formula | C16H30O6 |
| InChI | InChI=1S/C16H30O6/c1-19-11-13-21-15(17)9-7-5-3-4-6-8-10-16(18)22-14-12-20-2/h3-14H2,1-2H3 |
| InChIKey | JGDURTCBAJOZDJ-UHFFFAOYSA-N |
| Molecular Weight | 318.410 g/mol |
| SMILES | C(OC(CCCCCCCCC(OCCOC)=O)=O)COC |