| SpectraBase Compound ID | 3aGBPIT0yzy |
|---|---|
| InChI | InChI=1S/C7H5BrO2/c8-6-3-1-2-5(4-6)7(9)10/h1-4H,(H,9,10) |
| InChIKey | VOIZNVUXCQLQHS-UHFFFAOYSA-N |
| Mol Weight | 201.02 g/mol |
| Molecular Formula | C7H5BrO2 |
| Exact Mass | 199.947292 g/mol |
Mass Spectrum (GC)
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| SpectraBase Spectrum ID | CNXIHolHewH |
|---|---|
| Name | BENZOIC ACID, 3-BROMO- |
| Copyright | Copyright © 2002-2024 Wiley-VCH Verlag GmbH & Co. KGaA. All Rights Reserved. |
| Formula | C7H5O2Br |
| InChI | InChI=1S/C7H5BrO2/c8-6-3-1-2-5(4-6)7(9)10/h1-4H,(H,9,10) |
| InChIKey | VOIZNVUXCQLQHS-UHFFFAOYSA-N |
| Molecular Weight | 199.9471 |
| SMILES | OC(=O)c1cc(Br)ccc1 |
| SPLASH | splash10-0udi-9750000000-f0e8b4ad879ae3f996a5 |
| Source of Spectrum | Chemical Concepts, A Wiley Division, Weinheim, Germany |