| SpectraBase Compound ID | FtRCdWgRqIE |
|---|---|
| InChI | InChI=1S/C10H9BrO3/c1-6(12)8-4-3-7(11)5-9(8)10(13)14-2/h3-5H,1-2H3 |
| InChIKey | LDQUHAQECDPEOH-UHFFFAOYSA-N |
| Mol Weight | 257.08 g/mol |
| Molecular Formula | C10H9BrO3 |
| Exact Mass | 255.973507 g/mol |
Mass Spectrum (GC)
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| SpectraBase Spectrum ID | 33vJu9wfK4p |
|---|---|
| Name | Methyl 2-acetyl-5-bromobenzoate |
| Copyright | Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
| Formula | C10H9BrO3 |
| InChI | InChI=1S/C10H9BrO3/c1-6(12)8-4-3-7(11)5-9(8)10(13)14-2/h3-5H,1-2H3 |
| InChIKey | LDQUHAQECDPEOH-UHFFFAOYSA-N |
| Literature Reference DOI | 10.1021/acs.joc.5b01199 |
| Molecular Weight | 257.083 g/mol |
| SMILES | c1cc(c(cc1Br)C(=O)OC)C(=O)C |
| SPLASH | splash10-0006-0190000000-60c77aca0b2822f51e8a |
| Source of Spectrum | J-80-8109-13b |
| Wiley ID | 1801581 |