| SpectraBase Compound ID | EaTcJADuq8I |
|---|---|
| InChI | InChI=1S/C19H32BrO3P/c1-3-5-7-8-9-10-11-16-22-24(21,17-6-4-2)23-19-14-12-18(20)13-15-19/h12-15H,3-11,16-17H2,1-2H3 |
| InChIKey | FCSBFQVKQSQUEQ-UHFFFAOYSA-N |
| Mol Weight | 419.3 g/mol |
| Molecular Formula | C19H32BrO3P |
| Exact Mass | 418.127245 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | GSQDBdrNSBq |
|---|---|
| Name | Butylphosphonic acid, 4-bromophenyl nonyl ester |
| Comments | Computed using HOSE algorithm |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 418.127244885 u |
| Formula | C19H32BrO3P |
| InChI | InChI=1S/C19H32BrO3P/c1-3-5-7-8-9-10-11-16-22-24(21,17-6-4-2)23-19-14-12-18(20)13-15-19/h12-15H,3-11,16-17H2,1-2H3 |
| InChIKey | FCSBFQVKQSQUEQ-UHFFFAOYSA-N |
| Molecular Weight | 419.340 g/mol |
| SMILES | C1=C(C=CC(=C1)OP(CCCC)(=O)OCCCCCCCCC)Br |