| SpectraBase Compound ID | 4cwzEyjfLj5 |
|---|---|
| InChI | InChI=1S/C15H24NO5P/c1-4-12(2)14(11-21-22(3,18)19)16-15(17)20-10-13-8-6-5-7-9-13/h5-9,12,14H,4,10-11H2,1-3H3,(H,16,17)(H,18,19) |
| InChIKey | FCXRUIUHKOMVOH-UHFFFAOYSA-N |
| Mol Weight | 329.33 g/mol |
| Molecular Formula | C15H24NO5P |
| Exact Mass | 329.13921 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | 1S7rkFABae7 |
|---|---|
| Name | N-Carbobenzyloxyisoleucinol-1-methylphosphonate |
| Comments | Computed using HOSE algorithm |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 329.139209870 u |
| Formula | C15H24NO5P |
| InChI | InChI=1S/C15H24NO5P/c1-4-12(2)14(11-21-22(3,18)19)16-15(17)20-10-13-8-6-5-7-9-13/h5-9,12,14H,4,10-11H2,1-3H3,(H,16,17)(H,18,19) |
| InChIKey | FCXRUIUHKOMVOH-UHFFFAOYSA-N |
| Molecular Weight | 329.333 g/mol |
| SMILES | C1=CC=C(C=C1)COC(NC(C(C)CC)COP(=O)(C)O)=O |