| SpectraBase Compound ID | EtVXCoH4EAY |
|---|---|
| InChI | InChI=1S/C6H9ClO2/c1-4(8)5(9)6(2,3)7/h1-3H3 |
| InChIKey | QXEPSGKTHZVASJ-UHFFFAOYSA-N |
| Mol Weight | 148.59 g/mol |
| Molecular Formula | C6H9ClO2 |
| Exact Mass | 148.029107 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 | 9kX4IViz9RG |
|---|---|
| Name | 4-Chloro-4-methylpentane-2,3-dione |
| Comments | Computed using SmartSpectra Model v1.42 |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 148.029107228 u |
| Formula | C6H9ClO2 |
| InChI | InChI=1S/C6H9ClO2/c1-4(8)5(9)6(2,3)7/h1-3H3 |
| InChIKey | QXEPSGKTHZVASJ-UHFFFAOYSA-N |
| SMILES | CC(C(C(C)=O)=O)(Cl)C |
| Spectrum/Structure Validation Score (Vapor Phase IR) | 0.972773 |