| SpectraBase Compound ID | KKFyCL45bFN |
|---|---|
| InChI | InChI=1S/C12H18NO5P/c1-3-5-10-19(16,17-4-2)18-12-8-6-11(7-9-12)13(14)15/h6-9H,3-5,10H2,1-2H3 |
| InChIKey | MEVAOLBLFMAOEV-UHFFFAOYSA-N |
| Mol Weight | 287.25 g/mol |
| Molecular Formula | C12H18NO5P |
| Exact Mass | 287.09226 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | AmGbagTlfAU |
|---|---|
| Name | Butylphosphonic acid, ethyl 4-nitrophenyl ester |
| Comments | Computed using HOSE algorithm |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 287.092259677 u |
| Formula | C12H18NO5P |
| InChI | InChI=1S/C12H18NO5P/c1-3-5-10-19(16,17-4-2)18-12-8-6-11(7-9-12)13(14)15/h6-9H,3-5,10H2,1-2H3 |
| InChIKey | MEVAOLBLFMAOEV-UHFFFAOYSA-N |
| Molecular Weight | 287.252 g/mol |
| SMILES | CCOP(CCCC)(=O)OC1=CC=C(C=C1)N(=O)=O |