| SpectraBase Compound ID | Kmdf6efX7Wr |
|---|---|
| InChI | InChI=1S/C17H15ClF3NO5Si/c1-28(2,3)27-16(23)12-9-11(5-6-14(12)22(24)25)26-15-7-4-10(8-13(15)18)17(19,20)21/h4-9H,1-3H3 |
| InChIKey | LYBBQUWIIRSFIA-UHFFFAOYSA-N |
| Mol Weight | 433.84 g/mol |
| Molecular Formula | C17H15ClF3NO5Si |
| Exact Mass | 433.036011 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | BAC6zw3IjGx |
|---|---|
| Name | Acifluorfen, tms derivative |
| Comments | Computed using HOSE algorithm |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 433.036011306 u |
| Formula | C17H15ClF3NO5Si |
| InChI | InChI=1S/C17H15ClF3NO5Si/c1-28(2,3)27-16(23)12-9-11(5-6-14(12)22(24)25)26-15-7-4-10(8-13(15)18)17(19,20)21/h4-9H,1-3H3 |
| InChIKey | LYBBQUWIIRSFIA-UHFFFAOYSA-N |
| Molecular Weight | 433.842 g/mol |
| SMILES | C1(=CC=C(C=C1C(O[Si](C)(C)C)=O)OC1=CC=C(C=C1Cl)C(F)(F)F)N(=O)=O |