| SpectraBase Compound ID | ClG0Js3NHz5 |
|---|---|
| InChI | InChI=1S/C21H43O6P/c1-2-3-4-5-6-7-8-9-10-11-12-13-14-15-16-18-21(22)26-19-17-20-27-28(23,24)25/h2-20H2,1H3,(H2,23,24,25) |
| InChIKey | ABVLIFIBVDRIAP-UHFFFAOYSA-N |
| Mol Weight | 422.5 g/mol |
| Molecular Formula | C21H43O6P |
| Exact Mass | 422.279726 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | IwyCFEVopT5 |
|---|---|
| Name | 3-Stearoyloxypropylphosphoric acid |
| Comments | Computed using HOSE algorithm |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 422.279726097 u |
| Formula | C21H43O6P |
| InChI | InChI=1S/C21H43O6P/c1-2-3-4-5-6-7-8-9-10-11-12-13-14-15-16-18-21(22)26-19-17-20-27-28(23,24)25/h2-20H2,1H3,(H2,23,24,25) |
| InChIKey | ABVLIFIBVDRIAP-UHFFFAOYSA-N |
| Molecular Weight | 422.543 g/mol |
| SMILES | OP(=O)(O)OCCCOC(=O)CCCCCCCCCCCCCCCCC |