| SpectraBase Compound ID | E4MNFZi0iyv |
|---|---|
| InChI | InChI=1S/C16H27O3P/c1-3-5-13-18-20(17,15-6-4-2)19-14-12-16-10-8-7-9-11-16/h7-11H,3-6,12-15H2,1-2H3 |
| InChIKey | BRXKMQMJHRQABP-UHFFFAOYSA-N |
| Mol Weight | 298.36 g/mol |
| Molecular Formula | C16H27O3P |
| Exact Mass | 298.169782 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
View the Full Spectrum for FREE!
The full spectrum can only be viewed using a FREE account.
| SpectraBase Spectrum ID | 7uDM7VreQRv |
|---|---|
| Name | Butylphosphonic acid, butyl 2-phenylethyl ester |
| Comments | Computed using HOSE algorithm |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 298.169781724 u |
| Formula | C16H27O3P |
| InChI | InChI=1S/C16H27O3P/c1-3-5-13-18-20(17,15-6-4-2)19-14-12-16-10-8-7-9-11-16/h7-11H,3-6,12-15H2,1-2H3 |
| InChIKey | BRXKMQMJHRQABP-UHFFFAOYSA-N |
| Molecular Weight | 298.363 g/mol |
| SMILES | C(OP(CCCC)(=O)OCCCC)CC1=CC=CC=C1 |