| SpectraBase Compound ID | 80K2EFqZqdH |
|---|---|
| InChI | InChI=1S/C16H35O3P/c1-6-9-12-16(11-8-3)19-20(17,13-10-7-2)18-14-15(4)5/h15-16H,6-14H2,1-5H3 |
| InChIKey | XWVAFBHCKJXBAS-UHFFFAOYSA-N |
| Mol Weight | 306.4 g/mol |
| Molecular Formula | C16H35O3P |
| Exact Mass | 306.232382 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | uOsNjDvihl |
|---|---|
| Name | Butylphosphonic acid, 4-octyl isobutyl ester |
| Comments | Computed using HOSE algorithm |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 306.232381982 u |
| Formula | C16H35O3P |
| InChI | InChI=1S/C16H35O3P/c1-6-9-12-16(11-8-3)19-20(17,13-10-7-2)18-14-15(4)5/h15-16H,6-14H2,1-5H3 |
| InChIKey | XWVAFBHCKJXBAS-UHFFFAOYSA-N |
| Molecular Weight | 306.427 g/mol |
| SMILES | CC(C)COP(OC(CCC)CCCC)(CCCC)=O |