| SpectraBase Compound ID | KDR0eh0fFtt |
|---|---|
| InChI | InChI=1S/C17H29O3P/c1-4-6-10-14-19-21(18,17-12-8-7-9-13-17)20-15-16(3)11-5-2/h7-9,12-13,16H,4-6,10-11,14-15H2,1-3H3 |
| InChIKey | IWHXGYZDNYCRCI-UHFFFAOYSA-N |
| Mol Weight | 312.39 g/mol |
| Molecular Formula | C17H29O3P |
| Exact Mass | 312.185432 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 | JM1usmarrix |
|---|---|
| Name | Phenylphosphonic acid, 2-methylpentyl pentyl ester |
| Comments | Computed using HOSE algorithm |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 312.185431789 u |
| Formula | C17H29O3P |
| InChI | InChI=1S/C17H29O3P/c1-4-6-10-14-19-21(18,17-12-8-7-9-13-17)20-15-16(3)11-5-2/h7-9,12-13,16H,4-6,10-11,14-15H2,1-3H3 |
| InChIKey | IWHXGYZDNYCRCI-UHFFFAOYSA-N |
| Molecular Weight | 312.390 g/mol |
| SMILES | CCCCCOP(C1=CC=CC=C1)(=O)OCC(CCC)C |