| SpectraBase Compound ID | 74E6rhZ6qfM |
|---|---|
| InChI | InChI=1S/C6H9BrO4/c1-3-11-6(9)4(7)5(8)10-2/h4H,3H2,1-2H3 |
| InChIKey | OGGYASKKLGSDRJ-UHFFFAOYSA-N |
| Mol Weight | 225.04 g/mol |
| Molecular Formula | C6H9BrO4 |
| Exact Mass | 223.968422 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
View the Full Spectrum for FREE!
The full spectrum can only be viewed using a FREE account.
| SpectraBase Spectrum ID | H6MIMBbzJ15 |
|---|---|
| Name | Propanedioic acid, bromo-, ethyl methyl ester |
| Comments | Computed using HOSE algorithm |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 223.968421766 u |
| Formula | C6H9BrO4 |
| InChI | InChI=1S/C6H9BrO4/c1-3-11-6(9)4(7)5(8)10-2/h4H,3H2,1-2H3 |
| InChIKey | OGGYASKKLGSDRJ-UHFFFAOYSA-N |
| Molecular Weight | 225.038 g/mol |
| SMILES | C(=O)(OC)C(C(=O)OCC)Br |