| SpectraBase Compound ID | CLvxyjWfsWY |
|---|---|
| InChI | InChI=1S/C18H34O5/c1-3-5-14-22-17(19)12-10-8-6-7-9-11-13-18(20)23-16-15-21-4-2/h3-16H2,1-2H3 |
| InChIKey | CSOFVVLVKWMVDN-UHFFFAOYSA-N |
| Mol Weight | 330.5 g/mol |
| Molecular Formula | C18H34O5 |
| Exact Mass | 330.240624 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | 3sLkcstmzVM |
|---|---|
| Name | Sebacic acid, butyl 2-ethoxyethyl ester |
| Comments | Computed using HOSE algorithm |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 330.240624190 u |
| Formula | C18H34O5 |
| InChI | InChI=1S/C18H34O5/c1-3-5-14-22-17(19)12-10-8-6-7-9-11-13-18(20)23-16-15-21-4-2/h3-16H2,1-2H3 |
| InChIKey | CSOFVVLVKWMVDN-UHFFFAOYSA-N |
| Molecular Weight | 330.465 g/mol |
| SMILES | C(C(OCCOCC)=O)CCCCCCCC(OCCCC)=O |