| SpectraBase Compound ID | 9470YY6sIpY |
|---|---|
| InChI | InChI=1S/C13H19BrO2Si/c1-17(2,3)16-13(15)6-4-5-11-7-9-12(14)10-8-11/h7-10H,4-6H2,1-3H3 |
| InChIKey | MLUGGMKATCQUOQ-UHFFFAOYSA-N |
| Mol Weight | 315.28 g/mol |
| Molecular Formula | C13H19BrO2Si |
| Exact Mass | 314.033769 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | KRRAPU9AEMF |
|---|---|
| Name | 4-(4-Bromophenyl)butanoic acid, tms derivative |
| Comments | Computed using HOSE algorithm |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 314.033769385 u |
| Formula | C13H19BrO2Si |
| InChI | InChI=1S/C13H19BrO2Si/c1-17(2,3)16-13(15)6-4-5-11-7-9-12(14)10-8-11/h7-10H,4-6H2,1-3H3 |
| InChIKey | MLUGGMKATCQUOQ-UHFFFAOYSA-N |
| Molecular Weight | 315.282 g/mol |
| SMILES | C1(Br)=CC=C(C=C1)CCCC(=O)O[Si](C)(C)C |