| SpectraBase Compound ID | HQn5T3OodsH |
|---|---|
| InChI | InChI=1S/C23H48O2/c1-3-5-6-7-8-9-10-11-12-13-14-15-16-17-18-19-21-25-23-20-22-24-4-2/h3-23H2,1-2H3 |
| InChIKey | KGITULWCVXOERK-UHFFFAOYSA-N |
| Mol Weight | 356.6 g/mol |
| Molecular Formula | C23H48O2 |
| Exact Mass | 356.365431 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | LPCBFIGkTVT |
|---|---|
| Name | 1,3-Propanediol, ethyl octadecyl ether |
| Comments | Computed using HOSE algorithm |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 356.365430784 u |
| Formula | C23H48O2 |
| InChI | InChI=1S/C23H48O2/c1-3-5-6-7-8-9-10-11-12-13-14-15-16-17-18-19-21-25-23-20-22-24-4-2/h3-23H2,1-2H3 |
| InChIKey | KGITULWCVXOERK-UHFFFAOYSA-N |
| Molecular Weight | 356.635 g/mol |
| SMILES | C(COCC)COCCCCCCCCCCCCCCCCCC |