| SpectraBase Compound ID | Amzgrv7BQj |
|---|---|
| InChI | InChI=1S/C22H21O5P/c23-22(21-14-8-3-9-15-21)18-27-28(24,25-16-19-10-4-1-5-11-19)26-17-20-12-6-2-7-13-20/h1-15H,16-18H2 |
| InChIKey | WPQRQOJDLZMUOA-UHFFFAOYSA-N |
| Mol Weight | 396.38 g/mol |
| Molecular Formula | C22H21O5P |
| Exact Mass | 396.112661 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | 9K0q5ouN7oc |
|---|---|
| Name | .alpha.-(Dibenzylphosphoryloxy)-acetophenone |
| Comments | Computed using HOSE algorithm |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 396.112660769 u |
| Formula | C22H21O5P |
| InChI | InChI=1S/C22H21O5P/c23-22(21-14-8-3-9-15-21)18-27-28(24,25-16-19-10-4-1-5-11-19)26-17-20-12-6-2-7-13-20/h1-15H,16-18H2 |
| InChIKey | WPQRQOJDLZMUOA-UHFFFAOYSA-N |
| Molecular Weight | 396.379 g/mol |
| SMILES | C(OP(=O)(OCC1=CC=CC=C1)OCC1=CC=CC=C1)C(=O)C1=CC=CC=C1 |