| SpectraBase Compound ID | KUusVd3m6g0 |
|---|---|
| InChI | InChI=1S/C9H9BrO2/c1-5-3-6(2)8(10)4-7(5)9(11)12/h3-4H,1-2H3,(H,11,12) |
| InChIKey | GQDYGQDSEFKPQO-UHFFFAOYSA-N |
| Mol Weight | 229.07 g/mol |
| Molecular Formula | C9H9BrO2 |
| Exact Mass | 227.978593 g/mol |
Mass Spectrum (GC)
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| SpectraBase Spectrum ID | 3vUeEVEYyoC |
|---|---|
| Name | 5-BROMO-2,4-DIMETHYLBENZOIC ACID |
| Copyright | Copyright © 2002-2024 Wiley-VCH Verlag GmbH & Co. KGaA. All Rights Reserved. |
| Formula | C9H9O2Br |
| InChI | InChI=1S/C9H9BrO2/c1-5-3-6(2)8(10)4-7(5)9(11)12/h3-4H,1-2H3,(H,11,12) |
| InChIKey | GQDYGQDSEFKPQO-UHFFFAOYSA-N |
| Molecular Weight | 227.9783 |
| SMILES | OC(=O)c1c(C)cc(c(Br)c1)C |
| SPLASH | splash10-0h0r-9540000000-74059af3077114136ed7 |
| Source of Spectrum | Chemical Concepts, A Wiley Division, Weinheim, Germany |