| SpectraBase Compound ID | 3KmhuvAZMEb |
|---|---|
| InChI | InChI=1S/C12H23BrO2/c1-2-3-4-5-6-7-8-9-10-15-12(14)11-13/h2-11H2,1H3 |
| InChIKey | OMRFZIDOMSMRSP-UHFFFAOYSA-N |
| Mol Weight | 279.22 g/mol |
| Molecular Formula | C12H23BrO2 |
| Exact Mass | 278.088143 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | 6UFlA7B4sEz |
|---|---|
| Name | Bromoacetic acid, decyl ester |
| Comments | Computed using HOSE algorithm |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 278.088142979 u |
| Formula | C12H23BrO2 |
| InChI | InChI=1S/C12H23BrO2/c1-2-3-4-5-6-7-8-9-10-15-12(14)11-13/h2-11H2,1H3 |
| InChIKey | OMRFZIDOMSMRSP-UHFFFAOYSA-N |
| Molecular Weight | 279.218 g/mol |
| SMILES | C(Br)C(OCCCCCCCCCC)=O |