| SpectraBase Compound ID | Kl4yXM1q1uY |
|---|---|
| InChI | InChI=1S/C5H7BrO3/c1-9-5(8)2-4(7)3-6/h2-3H2,1H3 |
| InChIKey | CZRWOPRGDPUSDE-UHFFFAOYSA-N |
| Mol Weight | 195.01 g/mol |
| Molecular Formula | C5H7BrO3 |
| Exact Mass | 193.957857 g/mol |
Mass Spectrum (GC)
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| SpectraBase Spectrum ID | Y9cN5D8Yys |
|---|---|
| Name | 4-BROMO-3-OXOBUTYRIC ACID, METHYL ESTER |
| Copyright | Copyright © 2002-2025 Wiley-VCH GmbH. All Rights Reserved. |
| Formula | C5H7O3Br |
| InChI | InChI=1S/C5H7BrO3/c1-9-5(8)2-4(7)3-6/h2-3H2,1H3 |
| InChIKey | CZRWOPRGDPUSDE-UHFFFAOYSA-N |
| Molecular Weight | 193.9576 |
| SMILES | C(Br)C(CC(OC)=O)=O |
| SPLASH | splash10-0fr6-9600000000-2a3e6b77502cc8b3cb4a |
| Source of Spectrum | Chemical Concepts, A Wiley Division, Weinheim, Germany |