| SpectraBase Compound ID | 2obSi4x0OK9 |
|---|---|
| InChI | InChI=1S/C18H21O3P/c1-3-21-18(19)14-15(2)22(20,16-10-6-4-7-11-16)17-12-8-5-9-13-17/h4-13,15H,3,14H2,1-2H3 |
| InChIKey | IVVCTLVOLIKHTP-UHFFFAOYSA-N |
| Mol Weight | 316.34 g/mol |
| Molecular Formula | C18H21O3P |
| Exact Mass | 316.122832 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | GGvsZ7Prh4X |
|---|---|
| Name | Butanoic acid, 3-(diphenylphosphinyl)-, ethyl ester |
| Comments | Computed using HOSE algorithm |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 316.122831531 u |
| Formula | C18H21O3P |
| InChI | InChI=1S/C18H21O3P/c1-3-21-18(19)14-15(2)22(20,16-10-6-4-7-11-16)17-12-8-5-9-13-17/h4-13,15H,3,14H2,1-2H3 |
| InChIKey | IVVCTLVOLIKHTP-UHFFFAOYSA-N |
| Molecular Weight | 316.337 g/mol |
| SMILES | C(P(=O)(C1=CC=CC=C1)C=1C=CC=CC1)(CC(=O)OCC)C |