| SpectraBase Compound ID | 3tUO5lzArpS |
|---|---|
| InChI | InChI=1S/C16H27O4P/c1-5-6-11-21(17,19-12-14(2)3)20-13-15-7-9-16(18-4)10-8-15/h7-10,14H,5-6,11-13H2,1-4H3 |
| InChIKey | UDLOVYXAKXBLQD-UHFFFAOYSA-N |
| Mol Weight | 314.36 g/mol |
| Molecular Formula | C16H27O4P |
| Exact Mass | 314.164696 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | 7YfFw0tlLSe |
|---|---|
| Name | Butylphosphonic acid, isobutyl 4-methoxybenzyl ester |
| Comments | Computed using HOSE algorithm |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 314.164696343 u |
| Formula | C16H27O4P |
| InChI | InChI=1S/C16H27O4P/c1-5-6-11-21(17,19-12-14(2)3)20-13-15-7-9-16(18-4)10-8-15/h7-10,14H,5-6,11-13H2,1-4H3 |
| InChIKey | UDLOVYXAKXBLQD-UHFFFAOYSA-N |
| Molecular Weight | 314.362 g/mol |
| SMILES | C1(=CC=C(C=C1)OC)COP(=O)(CCCC)OCC(C)C |