| SpectraBase Compound ID | 743yoYkbYhw |
|---|---|
| InChI | InChI=1S/C4H5Br2ClO2/c1-9-4(8)2(5)3(6)7/h2-3H,1H3 |
| InChIKey | ZEYCMGFAAPGUMU-UHFFFAOYSA-N |
| Mol Weight | 280.34 g/mol |
| Molecular Formula | C4H5Br2ClO2 |
| Exact Mass | 277.834483 g/mol |
Vapor Phase (Gas) Infrared Spectrum
View the Full Spectrum for FREE!
The full spectrum can only be viewed using a FREE account.
| SpectraBase Spectrum ID | 9ZRiVEXvndR |
|---|---|
| Name | Erythro-3-chloro-2,3-dibromopropanoic acid methyl ester |
| Comments | Computed using SmartSpectra Model v1.42 |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 277.834483099 u |
| Formula | C4H5Br2ClO2 |
| InChI | InChI=1S/C4H5Br2ClO2/c1-9-4(8)2(5)3(6)7/h2-3H,1H3 |
| InChIKey | ZEYCMGFAAPGUMU-UHFFFAOYSA-N |
| SMILES | C(C(=O)OC)(C(Br)Cl)Br |
| Spectrum/Structure Validation Score (Vapor Phase IR) | 0.972019 |