| SpectraBase Compound ID | I7PrdpM8Sah |
|---|---|
| InChI | InChI=1S/C19H39O3P/c1-5-7-9-10-11-12-13-14-15-16-21-23(20,17-8-6-2)22-18-19(3)4/h14-15,19H,5-13,16-18H2,1-4H3/b15-14+ |
| InChIKey | HTTVQOXDLPPJRM-CCEZHUSRSA-N |
| Mol Weight | 346.5 g/mol |
| Molecular Formula | C19H39O3P |
| Exact Mass | 346.263682 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | 48sBthZ5WLt |
|---|---|
| Name | Butylphosphonic acid, isobutyl (E)-undec-2-enyl ester |
| Comments | Computed using HOSE algorithm |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 346.263682111 u |
| Formula | C19H39O3P |
| InChI | InChI=1S/C19H39O3P/c1-5-7-9-10-11-12-13-14-15-16-21-23(20,17-8-6-2)22-18-19(3)4/h14-15,19H,5-13,16-18H2,1-4H3/b15-14+ |
| InChIKey | HTTVQOXDLPPJRM-CCEZHUSRSA-N |
| Molecular Weight | 346.492 g/mol |
| SMILES | C(C\C=C\COP(CCCC)(OCC(C)C)=O)CCCCCC |