| SpectraBase Compound ID | 3QhQhJsx1fn |
|---|---|
| InChI | InChI=1S/C14H23O3P/c1-4-6-12-18(15,16-11-5-2)17-14-10-8-7-9-13(14)3/h7-10H,4-6,11-12H2,1-3H3 |
| InChIKey | SGVOCXXZMGRRLJ-UHFFFAOYSA-N |
| Mol Weight | 270.31 g/mol |
| Molecular Formula | C14H23O3P |
| Exact Mass | 270.138482 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | E2YrVdoZSV |
|---|---|
| Name | Butylphosphonic acid, 2-methylphenyl propyl ester |
| Comments | Computed using HOSE algorithm |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 270.138481596 u |
| Formula | C14H23O3P |
| InChI | InChI=1S/C14H23O3P/c1-4-6-12-18(15,16-11-5-2)17-14-10-8-7-9-13(14)3/h7-10H,4-6,11-12H2,1-3H3 |
| InChIKey | SGVOCXXZMGRRLJ-UHFFFAOYSA-N |
| Molecular Weight | 270.309 g/mol |
| SMILES | CCCCP(OC1=CC=CC=C1C)(=O)OCCC |