| SpectraBase Compound ID | Kfvx2cQs7nq |
|---|---|
| InChI | InChI=1S/C17H37O4P/c1-6-8-10-17(11-12-19-5)15-21-22(18,13-9-7-2)20-14-16(3)4/h16-17H,6-15H2,1-5H3 |
| InChIKey | FOTVKJOTFQZTNP-UHFFFAOYSA-N |
| Mol Weight | 336.5 g/mol |
| Molecular Formula | C17H37O4P |
| Exact Mass | 336.242947 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | 323c5jS1oh9 |
|---|---|
| Name | Butylphosphonic acid, 2-(2-methoxyethyl)hexyl isobutyl ester |
| Comments | Computed using HOSE algorithm |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 336.242946665 u |
| Formula | C17H37O4P |
| InChI | InChI=1S/C17H37O4P/c1-6-8-10-17(11-12-19-5)15-21-22(18,13-9-7-2)20-14-16(3)4/h16-17H,6-15H2,1-5H3 |
| InChIKey | FOTVKJOTFQZTNP-UHFFFAOYSA-N |
| Molecular Weight | 336.453 g/mol |
| SMILES | COCCC(COP(CCCC)(=O)OCC(C)C)CCCC |