| SpectraBase Compound ID | 8gxrn7KzgeE |
|---|---|
| InChI | InChI=1S/C24H46O6/c1-21(13-17-27-3)15-19-29-23(25)11-9-7-5-6-8-10-12-24(26)30-20-16-22(2)14-18-28-4/h21-22H,5-20H2,1-4H3 |
| InChIKey | OENXKTXOEBGLAN-UHFFFAOYSA-N |
| Mol Weight | 430.6 g/mol |
| Molecular Formula | C24H46O6 |
| Exact Mass | 430.329439 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | EsU0TmEIz4m |
|---|---|
| Name | Sebacic acid, di(5-methoxy-3-methylpentyl) ester |
| Comments | Computed using HOSE algorithm |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 430.329439195 u |
| Formula | C24H46O6 |
| InChI | InChI=1S/C24H46O6/c1-21(13-17-27-3)15-19-29-23(25)11-9-7-5-6-8-10-12-24(26)30-20-16-22(2)14-18-28-4/h21-22H,5-20H2,1-4H3 |
| InChIKey | OENXKTXOEBGLAN-UHFFFAOYSA-N |
| Molecular Weight | 430.626 g/mol |
| SMILES | C(CCCCCCCCC(OCCC(C)CCOC)=O)(OCCC(C)CCOC)=O |