| SpectraBase Compound ID | 3DwCMT2iAr2 |
|---|---|
| InChI | InChI=1S/C11H16FO3P/c1-3-14-16(13,15-4-2)9-10-7-5-6-8-11(10)12/h5-8H,3-4,9H2,1-2H3 |
| InChIKey | VLIMXNFVVHBLMJ-UHFFFAOYSA-N |
| Mol Weight | 246.22 g/mol |
| Molecular Formula | C11H16FO3P |
| Exact Mass | 246.08211 g/mol |
Raman Spectrum
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| SpectraBase Spectrum ID | DFQqFpTZMFf |
|---|---|
| Name | Diethyl-2-fluorbenzylphosphonat |
| Comments | Computed using SmartSpectra Model v1.42 |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 246.082109533 u |
| Formula | C11H16FO3P |
| InChI | InChI=1S/C11H16FO3P/c1-3-14-16(13,15-4-2)9-10-7-5-6-8-11(10)12/h5-8H,3-4,9H2,1-2H3 |
| InChIKey | VLIMXNFVVHBLMJ-UHFFFAOYSA-N |
| Molecular Weight | 246.218 g/mol |
| SMILES | C=1(F)C=CC=CC1CP(=O)(OCC)OCC |
| Spectrum/Structure Validation Score (Raman) | 0.889516 |