| SpectraBase Compound ID | 6dMlK54XaGk |
|---|---|
| InChI | InChI=1S/C30H58O4/c1-5-7-9-11-15-19-23-27(3)33-29(31)25-21-17-13-14-18-22-26-30(32)34-28(4)24-20-16-12-10-8-6-2/h27-28H,5-26H2,1-4H3 |
| InChIKey | PNYAXUCYPDSBJE-UHFFFAOYSA-N |
| Mol Weight | 482.8 g/mol |
| Molecular Formula | C30H58O4 |
| Exact Mass | 482.43351 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | 9zINeXTknoA |
|---|---|
| Name | Sebacic acid, di(2-decyl) ester |
| Comments | Computed using HOSE algorithm |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 482.433510344 u |
| Formula | C30H58O4 |
| InChI | InChI=1S/C30H58O4/c1-5-7-9-11-15-19-23-27(3)33-29(31)25-21-17-13-14-18-22-26-30(32)34-28(4)24-20-16-12-10-8-6-2/h27-28H,5-26H2,1-4H3 |
| InChIKey | PNYAXUCYPDSBJE-UHFFFAOYSA-N |
| Molecular Weight | 482.790 g/mol |
| SMILES | C(CCCCCCCCC(OC(C)CCCCCCCC)=O)(OC(C)CCCCCCCC)=O |