| SpectraBase Compound ID | 3PBtNDjWo5F |
|---|---|
| InChI | InChI=1S/C19H23O3P/c1-16(17-11-7-5-8-12-17)22-23(20,21-15-19(2,3)4)18-13-9-6-10-14-18/h5-14H,1,15H2,2-4H3 |
| InChIKey | VRHCBASEBIMSQQ-UHFFFAOYSA-N |
| Mol Weight | 330.36 g/mol |
| Molecular Formula | C19H23O3P |
| Exact Mass | 330.138482 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | FA7O13h817N |
|---|---|
| Name | Neopentyl-1-phenylvinyl-phenylphosphonate |
| Comments | Computed using HOSE algorithm |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 330.138481596 u |
| Formula | C19H23O3P |
| InChI | InChI=1S/C19H23O3P/c1-16(17-11-7-5-8-12-17)22-23(20,21-15-19(2,3)4)18-13-9-6-10-14-18/h5-14H,1,15H2,2-4H3 |
| InChIKey | VRHCBASEBIMSQQ-UHFFFAOYSA-N |
| Molecular Weight | 330.364 g/mol |
| SMILES | C(OP(OCC(C)(C)C)(=O)C=1C=CC=CC1)(C1=CC=CC=C1)=C |