| SpectraBase Compound ID | 63Ros7y7gZX |
|---|---|
| InChI | InChI=1S/C25H46O5/c1-2-3-4-5-6-9-12-15-20-29-24(26)18-13-10-7-8-11-14-19-25(27)30-22-23-17-16-21-28-23/h23H,2-22H2,1H3 |
| InChIKey | JUCDRMZTSWSQON-UHFFFAOYSA-N |
| Mol Weight | 426.6 g/mol |
| Molecular Formula | C25H46O5 |
| Exact Mass | 426.334525 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | HpZTuZ2JCQs |
|---|---|
| Name | Sebacic acid, decyl tetrahydrofurfuryl ester |
| Comments | Computed using HOSE algorithm |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 426.334524576 u |
| Formula | C25H46O5 |
| InChI | InChI=1S/C25H46O5/c1-2-3-4-5-6-9-12-15-20-29-24(26)18-13-10-7-8-11-14-19-25(27)30-22-23-17-16-21-28-23/h23H,2-22H2,1H3 |
| InChIKey | JUCDRMZTSWSQON-UHFFFAOYSA-N |
| Molecular Weight | 426.638 g/mol |
| SMILES | C1(CCCO1)COC(CCCCCCCCC(OCCCCCCCCCC)=O)=O |