| SpectraBase Compound ID | EeKbj9ps83g |
|---|---|
| InChI | InChI=1S/C16H32ClO3P/c1-3-5-9-12-19-21(18,13-6-4-2)20-14-15-10-7-8-11-16(15)17/h15-16H,3-14H2,1-2H3 |
| InChIKey | CZCNCTAUEOSNPJ-UHFFFAOYSA-N |
| Mol Weight | 338.9 g/mol |
| Molecular Formula | C16H32ClO3P |
| Exact Mass | 338.17776 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 | GOG2szJpAW4 |
|---|---|
| Name | Butylphosphonic acid, 2-chlorocyclohexylmethyl pentyl ester |
| Comments | Computed using HOSE algorithm |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 338.177759585 u |
| Formula | C16H32ClO3P |
| InChI | InChI=1S/C16H32ClO3P/c1-3-5-9-12-19-21(18,13-6-4-2)20-14-15-10-7-8-11-16(15)17/h15-16H,3-14H2,1-2H3 |
| InChIKey | CZCNCTAUEOSNPJ-UHFFFAOYSA-N |
| Molecular Weight | 338.856 g/mol |
| SMILES | CCCCCOP(CCCC)(=O)OCC1C(CCCC1)Cl |