| SpectraBase Compound ID | nET4VEdjeY |
|---|---|
| InChI | InChI=1S/C4H3ClO3/c5-3-2(6)1-8-4(3)7/h3H,1H2 |
| InChIKey | DJEJYZZJYYNADA-UHFFFAOYSA-N |
| Mol Weight | 134.52 g/mol |
| Molecular Formula | C4H3ClO3 |
| Exact Mass | 133.977072 g/mol |
| SpectraBase Spectrum ID | 2i1JBzufJrv |
|---|---|
| Name | 3-Chloro-2,4(3H,5H)-furandione |
| Comments | Computed using SmartSpectra Model v1.42 |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 133.977071654 u |
| Formula | C4H3ClO3 |
| InChI | InChI=1S/C4H3ClO3/c5-3-2(6)1-8-4(3)7/h3H,1H2 |
| InChIKey | DJEJYZZJYYNADA-UHFFFAOYSA-N |
| SMILES | C1(C(OCC1=O)=O)Cl |
| Spectrum/Structure Validation Score (Raman) | 0.729477 |