| SpectraBase Compound ID | LPWod7IPg5I |
|---|---|
| InChI | InChI=1S/C5H7BrO2/c1-8-5(7)3-2-4-6/h2-3H,4H2,1H3/b3-2+ |
| InChIKey | RWIKCBHOVNDESJ-NSCUHMNNSA-N |
| Mol Weight | 179.01 g/mol |
| Molecular Formula | C5H7BrO2 |
| Exact Mass | 177.962942 g/mol |
Mass Spectrum (GC)
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| SpectraBase Spectrum ID | HWtbmhvg28S |
|---|---|
| Name | 2-BUTENOIC ACID, 4-BROMO-, METHYL ESTER |
| Copyright | Copyright © 2002-2025 Wiley-VCH GmbH. All Rights Reserved. |
| Formula | C5H7BrO2 |
| InChI | InChI=1S/C5H7BrO2/c1-8-5(7)3-2-4-6/h2-3H,4H2,1H3/b3-2+ |
| InChIKey | RWIKCBHOVNDESJ-NSCUHMNNSA-N |
| Instrument Name | 311A |
| Molecular Weight | 177.9627 |
| SMILES | C(Br)\C=C\C(OC)=O |
| SPLASH | splash10-0002-9400000000-c823501f52ea69548bdf |
| Source of Spectrum | Chemical Concepts, A Wiley Division, Weinheim, Germany |