| SpectraBase Compound ID | 43VJJfIEsKq |
|---|---|
| InChI | InChI=1S/C21H44O2/c1-3-5-6-7-8-9-10-11-12-13-14-15-16-17-19-23-21-18-20-22-4-2/h3-21H2,1-2H3 |
| InChIKey | JHCSLWDHWPAAFF-UHFFFAOYSA-N |
| Mol Weight | 328.6 g/mol |
| Molecular Formula | C21H44O2 |
| Exact Mass | 328.334131 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | 3WlMYxXCFD8 |
|---|---|
| Name | 1,3-Propanediol, ethyl hexadecyl ether |
| Comments | Computed using HOSE algorithm |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 328.334130655 u |
| Formula | C21H44O2 |
| InChI | InChI=1S/C21H44O2/c1-3-5-6-7-8-9-10-11-12-13-14-15-16-17-19-23-21-18-20-22-4-2/h3-21H2,1-2H3 |
| InChIKey | JHCSLWDHWPAAFF-UHFFFAOYSA-N |
| Molecular Weight | 328.581 g/mol |
| SMILES | C(COCC)COCCCCCCCCCCCCCCCC |