| SpectraBase Compound ID | ovb4kHsXl8 |
|---|---|
| InChI | InChI=1S/C18H36O6/c1-16(15-18(2,3)4)14-17(19)24-13-12-23-11-10-22-9-8-21-7-6-20-5/h16H,6-15H2,1-5H3 |
| InChIKey | DJHOALZJBLVEER-UHFFFAOYSA-N |
| Mol Weight | 348.5 g/mol |
| Molecular Formula | C18H36O6 |
| Exact Mass | 348.251189 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | 3xBAIxT7Yrb |
|---|---|
| Name | 2,5,8,11-Tetraoxatridecan-13-yl 3,5,5-trimethylhexanoate |
| Comments | Computed using HOSE algorithm |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 348.251188873 u |
| Formula | C18H36O6 |
| InChI | InChI=1S/C18H36O6/c1-16(15-18(2,3)4)14-17(19)24-13-12-23-11-10-22-9-8-21-7-6-20-5/h16H,6-15H2,1-5H3 |
| InChIKey | DJHOALZJBLVEER-UHFFFAOYSA-N |
| Molecular Weight | 348.480 g/mol |
| SMILES | C(OC(CC(CC(C)(C)C)C)=O)COCCOCCOCCOC |