| SpectraBase Compound ID | 2iuWTWWJ895 |
|---|---|
| InChI | InChI=1S/C8H5BrO3/c9-6-2-8-7(11-4-12-8)1-5(6)3-10/h1-3H,4H2 |
| InChIKey | CSQUXTSIDQURDV-UHFFFAOYSA-N |
| Mol Weight | 229.03 g/mol |
| Molecular Formula | C8H5BrO3 |
| Exact Mass | 227.942207 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | 1gsJqZnyrVD |
|---|---|
| Name | 6-Bromo-piperonal |
| Copyright | Copyright © 2002-2024 Wiley-VCH Verlag GmbH & Co. KGaA. All Rights Reserved. |
| Formula | C8H5BrO3 |
| InChI | InChI=1S/C8H5BrO3/c9-6-2-8-7(11-4-12-8)1-5(6)3-10/h1-3H,4H2 |
| InChIKey | CSQUXTSIDQURDV-UHFFFAOYSA-N |
| Instrument Name | SF = 270 MHz |
| Literature Reference | A.I. Meyers, J.R. Flisak, R.A.Aitken, J. Am. Chem. Soc. 109, 5446 (1987). |
| NMR Standard | TMS |
| Origin | Chemical Concepts. A Wiley Division. Weinheim, Germany |
| Solvent | CDCl3 |