| SpectraBase Compound ID | CQ8ULAlE5ry |
|---|---|
| InChI | InChI=1S/C21H21O3P/c1-16-4-10-19(11-5-16)22-25(23-20-12-6-17(2)7-13-20)24-21-14-8-18(3)9-15-21/h4-15H,1-3H3 |
| InChIKey | FEVFLQDDNUQKRY-UHFFFAOYSA-N |
| Mol Weight | 352.37 g/mol |
| Molecular Formula | C21H21O3P |
| Exact Mass | 352.122832 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | A8r3LjKW5da |
|---|---|
| Name | Phosphorous acid, tri-p-tolyl ester |
| Comments | Computed using HOSE algorithm |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 352.122831531 u |
| Formula | C21H21O3P |
| InChI | InChI=1S/C21H21O3P/c1-16-4-10-19(11-5-16)22-25(23-20-12-6-17(2)7-13-20)24-21-14-8-18(3)9-15-21/h4-15H,1-3H3 |
| InChIKey | FEVFLQDDNUQKRY-UHFFFAOYSA-N |
| Molecular Weight | 352.370 g/mol |
| SMILES | C=1(OP(OC=2C=CC(=CC2)C)OC=2C=CC(=CC2)C)C=CC(=CC1)C |