| SpectraBase Compound ID | CJCksjSlCSd |
|---|---|
| InChI | InChI=1S/C21H21O4P/c22-21(20-14-8-3-9-15-20)26(23,24-16-18-10-4-1-5-11-18)25-17-19-12-6-2-7-13-19/h1-15,21-22H,16-17H2 |
| InChIKey | CXXHOMAIPKBMEZ-UHFFFAOYSA-N |
| Mol Weight | 368.37 g/mol |
| Molecular Formula | C21H21O4P |
| Exact Mass | 368.117746 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | DKE7Bbpdnsj |
|---|---|
| Name | Dibenzyl (hydroxy-phenyl-methyl)-phosphonate |
| Comments | Computed using HOSE algorithm |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 368.117746150 u |
| Formula | C21H21O4P |
| InChI | InChI=1S/C21H21O4P/c22-21(20-14-8-3-9-15-20)26(23,24-16-18-10-4-1-5-11-18)25-17-19-12-6-2-7-13-19/h1-15,21-22H,16-17H2 |
| InChIKey | CXXHOMAIPKBMEZ-UHFFFAOYSA-N |
| Molecular Weight | 368.369 g/mol |
| SMILES | C1=CC=CC(C(P(=O)(OCC2=CC=CC=C2)OCC2=CC=CC=C2)O)=C1 |