SpectraBase Compound ID | HOECvSxlDDo |
---|---|
InChI | InChI=1S/C5H3ClO3/c1-2-3(6)5(8)9-4(2)7/h1H3 |
InChIKey | OZSFGOBDSDVGGY-UHFFFAOYSA-N |
Mol Weight | 146.53 g/mol |
Molecular Formula | C5H3ClO3 |
Exact Mass | 145.977072 g/mol |
SpectraBase Spectrum ID | IAZGTfQCBML |
---|---|
Name | 2-Chloro-3-methylmaleic anhydride |
Comments | Computed using SmartSpectra Model v1.42 |
Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
Exact Mass | 145.977071654 u |
Formula | C5H3ClO3 |
InChI | InChI=1S/C5H3ClO3/c1-2-3(6)5(8)9-4(2)7/h1H3 |
InChIKey | OZSFGOBDSDVGGY-UHFFFAOYSA-N |
SMILES | CC1=C(Cl)C(=O)OC1=O |
Spectrum/Structure Validation Score (Vapor Phase IR) | 0.981209 |