| SpectraBase Compound ID | 17nW84EyoVU |
|---|---|
| InChI | InChI=1S/C31H64O2/c1-3-5-6-7-8-9-10-11-12-13-14-15-16-17-18-19-20-21-22-23-24-25-26-27-29-33-31-28-30-32-4-2/h3-31H2,1-2H3 |
| InChIKey | JYFLQDVUVLULNX-UHFFFAOYSA-N |
| Mol Weight | 468.9 g/mol |
| Molecular Formula | C31H64O2 |
| Exact Mass | 468.490631 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | JzmewB0z3G2 |
|---|---|
| Name | 1,3-Propanediol, ethyl hexacosyl ether |
| Comments | Computed using HOSE algorithm |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 468.490631299 u |
| Formula | C31H64O2 |
| InChI | InChI=1S/C31H64O2/c1-3-5-6-7-8-9-10-11-12-13-14-15-16-17-18-19-20-21-22-23-24-25-26-27-29-33-31-28-30-32-4-2/h3-31H2,1-2H3 |
| InChIKey | JYFLQDVUVLULNX-UHFFFAOYSA-N |
| Molecular Weight | 468.851 g/mol |
| SMILES | C(COCC)COCCCCCCCCCCCCCCCCCCCCCCCCCC |