| SpectraBase Compound ID | 6hZdLKI6y2M |
|---|---|
| InChI | InChI=1S/C13H17BrO3/c1-3-17-12(15)11(14)13(2,16)9-10-7-5-4-6-8-10/h4-8,11,16H,3,9H2,1-2H3 |
| InChIKey | PPADNEHLCMTLBY-UHFFFAOYSA-N |
| Mol Weight | 301.18 g/mol |
| Molecular Formula | C13H17BrO3 |
| Exact Mass | 300.036107 g/mol |
Mass Spectrum (GC)
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| SpectraBase Spectrum ID | 6iZZAL2Tq46 |
|---|---|
| Name | Ethyl 2-Bromo-3-hydroxy-3-methyl-4-phenylbutanoate |
| Copyright | Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
| Formula | C13H17BrO3 |
| InChI | InChI=1S/C13H17BrO3/c1-3-17-12(15)11(14)13(2,16)9-10-7-5-4-6-8-10/h4-8,11,16H,3,9H2,1-2H3 |
| InChIKey | PPADNEHLCMTLBY-UHFFFAOYSA-N |
| Molecular Weight | 301.180 g/mol |
| SMILES | OC(C(C(=O)OCC)Br)(Cc1ccccc1)C |
| SPLASH | splash10-0006-9030000000-e7369a48e1779d69321e |
| Source of Spectrum | K1-0-2199-1 |
| Wiley ID | 1588801 |