| SpectraBase Compound ID | BY4D5swyiBG |
|---|---|
| InChI | InChI=1S/C12H17BrO3Si/c1-9-5-6-11(10(13)7-9)15-8-12(14)16-17(2,3)4/h5-7H,8H2,1-4H3 |
| InChIKey | RCWVIJSPPUGMIK-UHFFFAOYSA-N |
| Mol Weight | 317.25 g/mol |
| Molecular Formula | C12H17BrO3Si |
| Exact Mass | 316.013034 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | 7C5UOxMAbbj |
|---|---|
| Name | (2-Bromo-4-methylphenoxy)acetic acid, tms derivative |
| Comments | Computed using HOSE algorithm |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 316.013033939 u |
| Formula | C12H17BrO3Si |
| InChI | InChI=1S/C12H17BrO3Si/c1-9-5-6-11(10(13)7-9)15-8-12(14)16-17(2,3)4/h5-7H,8H2,1-4H3 |
| InChIKey | RCWVIJSPPUGMIK-UHFFFAOYSA-N |
| Molecular Weight | 317.254 g/mol |
| SMILES | C1(Br)=C(C=CC(=C1)C)OCC(=O)O[Si](C)(C)C |