| SpectraBase Compound ID | 3FZioCJagpR |
|---|---|
| InChI | InChI=1S/C19H37O3P/c1-4-7-9-10-11-12-13-14-15-16-17-18-22-23(20,21-6-3)19-8-5-2/h4-15,18-19H2,1-3H3 |
| InChIKey | WMAMTUUZQQYXMQ-UHFFFAOYSA-N |
| Mol Weight | 344.5 g/mol |
| Molecular Formula | C19H37O3P |
| Exact Mass | 344.248032 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | 1Q0tZs6F9Oz |
|---|---|
| Name | Butylphosphonic acid, ethyl tridec-2-ynyl ester |
| Comments | Computed using HOSE algorithm |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 344.248032046 u |
| Formula | C19H37O3P |
| InChI | InChI=1S/C19H37O3P/c1-4-7-9-10-11-12-13-14-15-16-17-18-22-23(20,21-6-3)19-8-5-2/h4-15,18-19H2,1-3H3 |
| InChIKey | WMAMTUUZQQYXMQ-UHFFFAOYSA-N |
| Molecular Weight | 344.476 g/mol |
| SMILES | C(OP(CCCC)(OCC)=O)C#CCCCCCCCCCC |