| SpectraBase Compound ID | BEfeW67YDCU |
|---|---|
| InChI | InChI=1S/C29H60O3/c1-3-5-7-9-11-13-15-16-18-20-22-24-26-32-29(27-30)28-31-25-23-21-19-17-14-12-10-8-6-4-2/h29-30H,3-28H2,1-2H3 |
| InChIKey | QSBCCDHSFNMSRF-UHFFFAOYSA-N |
| Mol Weight | 456.8 g/mol |
| Molecular Formula | C29H60O3 |
| Exact Mass | 456.454246 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | IihPDoedDy1 |
|---|---|
| Name | 3-(Dodecyloxy)-2-(tetradecyloxy)-1-propanol |
| Comments | Computed using HOSE algorithm |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 456.454245789 u |
| Formula | C29H60O3 |
| InChI | InChI=1S/C29H60O3/c1-3-5-7-9-11-13-15-16-18-20-22-24-26-32-29(27-30)28-31-25-23-21-19-17-14-12-10-8-6-4-2/h29-30H,3-28H2,1-2H3 |
| InChIKey | QSBCCDHSFNMSRF-UHFFFAOYSA-N |
| Molecular Weight | 456.796 g/mol |
| SMILES | OCC(COCCCCCCCCCCCC)OCCCCCCCCCCCCCC |