| SpectraBase Spectrum ID |
AtYCFG6sQvq |
| Name |
6-Chloro-2-oxo-2H-chromene-3-carboxylic acid |
| Comments |
Computed using SmartSpectra Model v1.42 |
| Copyright |
Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass |
223.987636337 u |
| Formula |
C10H5ClO4 |
| InChI |
InChI=1S/C10H5ClO4/c11-6-1-2-8-5(3-6)4-7(9(12)13)10(14)15-8/h1-4H,(H,12,13) |
| InChIKey |
FOEGEQQPOKZIAB-UHFFFAOYSA-N |
| Molecular Weight |
224.599 g/mol |
| SMILES |
C(O)(=O)C1=CC2=C(OC1=O)C=CC(=C2)Cl |
| Spectrum/Structure Validation Score (Vapor Phase IR) |
0.95904 |
