| SpectraBase Compound ID | 49lcljjngZa |
|---|---|
| InChI | InChI=1S/C18H37O3P/c1-4-7-9-10-11-12-13-14-15-17-21-22(19,18-8-5-2)20-16-6-3/h14-15H,4-13,16-18H2,1-3H3/b15-14+ |
| InChIKey | ISNMTQVKYRCFLS-CCEZHUSRSA-N |
| Mol Weight | 332.5 g/mol |
| Molecular Formula | C18H37O3P |
| Exact Mass | 332.248032 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | FAjdUeADz5Z |
|---|---|
| Name | Butylphosphonic acid, propyl (E)-undec-2-enyl ester |
| Comments | Computed using HOSE algorithm |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 332.248032046 u |
| Formula | C18H37O3P |
| InChI | InChI=1S/C18H37O3P/c1-4-7-9-10-11-12-13-14-15-17-21-22(19,18-8-5-2)20-16-6-3/h14-15H,4-13,16-18H2,1-3H3/b15-14+ |
| InChIKey | ISNMTQVKYRCFLS-CCEZHUSRSA-N |
| Molecular Weight | 332.465 g/mol |
| SMILES | C(\C=C\COP(CCCC)(OCCC)=O)CCCCCCC |