| SpectraBase Compound ID | AeBJlhAHtQt |
|---|---|
| InChI | InChI=1S/C9H5BrO2/c10-7-5-6-3-1-2-4-8(6)12-9(7)11/h1-5H |
| InChIKey | DZCTYFCCOGXULA-UHFFFAOYSA-N |
| Mol Weight | 225.04 g/mol |
| Molecular Formula | C9H5BrO2 |
| Exact Mass | 223.947292 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | K3C5IPzL20T |
|---|---|
| Name | 3-Bromo-coumarin |
| CAS Registry Number | 939-18-4 |
| Copyright | Copyright © 2002-2024 Wiley-VCH Verlag GmbH & Co. KGaA. All Rights Reserved. |
| Formula | C9H5BrO2 |
| InChI | InChI=1S/C9H5BrO2/c10-7-5-6-3-1-2-4-8(6)12-9(7)11/h1-5H |
| InChIKey | DZCTYFCCOGXULA-UHFFFAOYSA-N |
| Literature Reference | H. Duddeck, M. Kaiser, Org. Magn. Resonance 20, 55 (1982). |
| NMR Standard | TMS |
| Origin | Chemical Concepts. A Wiley Division. Weinheim, Germany |
| Solvent | CDCl3 |