| SpectraBase Compound ID | EmOq3ToQfxi |
|---|---|
| InChI | InChI=1S/C17H19Cl2NO2Si/c1-23(2,3)22-16(21)11-12-7-4-5-10-15(12)20-17-13(18)8-6-9-14(17)19/h4-10,20H,11H2,1-3H3 |
| InChIKey | MOCCIDNUAYOGDC-UHFFFAOYSA-N |
| Mol Weight | 368.34 g/mol |
| Molecular Formula | C17H19Cl2NO2Si |
| Exact Mass | 367.056211 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | 9ZCYlYFm6BJ |
|---|---|
| Name | Diclofenac, tms derivative |
| Comments | Computed using HOSE algorithm |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 367.056210789 u |
| Formula | C17H19Cl2NO2Si |
| InChI | InChI=1S/C17H19Cl2NO2Si/c1-23(2,3)22-16(21)11-12-7-4-5-10-15(12)20-17-13(18)8-6-9-14(17)19/h4-10,20H,11H2,1-3H3 |
| InChIKey | MOCCIDNUAYOGDC-UHFFFAOYSA-N |
| Molecular Weight | 368.335 g/mol |
| SMILES | C(O[Si](C)(C)C)(CC1=CC=CC=C1NC1=C(Cl)C=CC=C1Cl)=O |