| SpectraBase Compound ID | 4HrI1WueQk2 |
|---|---|
| InChI | InChI=1S/C18H30ClO3P/c1-3-5-7-8-9-10-14-21-23(20,15-6-4-2)22-18-13-11-12-17(19)16-18/h11-13,16H,3-10,14-15H2,1-2H3 |
| InChIKey | RNYRYEXYSDZQND-UHFFFAOYSA-N |
| Mol Weight | 360.86 g/mol |
| Molecular Formula | C18H30ClO3P |
| Exact Mass | 360.16211 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | 6O0c1JF2VXg |
|---|---|
| Name | Butylphosphonic acid, 3-chlorophenyl octyl ester |
| Comments | Computed using HOSE algorithm |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 360.162109521 u |
| Formula | C18H30ClO3P |
| InChI | InChI=1S/C18H30ClO3P/c1-3-5-7-8-9-10-14-21-23(20,15-6-4-2)22-18-13-11-12-17(19)16-18/h11-13,16H,3-10,14-15H2,1-2H3 |
| InChIKey | RNYRYEXYSDZQND-UHFFFAOYSA-N |
| Molecular Weight | 360.862 g/mol |
| SMILES | CCCCCCCCOP(CCCC)(=O)OC1=CC=CC(=C1)Cl |