| SpectraBase Compound ID | JQ3g1Kg8rXs |
|---|---|
| InChI | InChI=1S/C17H35O3P/c1-4-7-9-10-11-12-13-14-15-16-20-21(18,19-6-3)17-8-5-2/h14-15H,4-13,16-17H2,1-3H3/b15-14+ |
| InChIKey | MLGWAKBRDVRMKJ-CCEZHUSRSA-N |
| Mol Weight | 318.4 g/mol |
| Molecular Formula | C17H35O3P |
| Exact Mass | 318.232382 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | 1broMpI2k8r |
|---|---|
| Name | Butylphosphonic acid, ethyl (E)-undec-2-enyl ester |
| Comments | Computed using HOSE algorithm |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 318.232381982 u |
| Formula | C17H35O3P |
| InChI | InChI=1S/C17H35O3P/c1-4-7-9-10-11-12-13-14-15-16-20-21(18,19-6-3)17-8-5-2/h14-15H,4-13,16-17H2,1-3H3/b15-14+ |
| InChIKey | MLGWAKBRDVRMKJ-CCEZHUSRSA-N |
| Molecular Weight | 318.438 g/mol |
| SMILES | CCOP(CCCC)(=O)OC\C=C\CCCCCCCC |