| SpectraBase Compound ID | 370XFDhgGfK |
|---|---|
| InChI | InChI=1S/C6H11ClO2/c1-3-4-9-6(8)5(2)7/h5H,3-4H2,1-2H3 |
| InChIKey | XVDQGLUGZORASO-UHFFFAOYSA-N |
| Mol Weight | 150.6 g/mol |
| Molecular Formula | C6H11ClO2 |
| Exact Mass | 150.044757 g/mol |
Raman Spectrum
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| SpectraBase Spectrum ID | 6YLINiQDr3X |
|---|---|
| Name | 2-Chloropropionic acid, propyl ester |
| Comments | Computed using SmartSpectra Model v1.42 |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 150.044757292 u |
| Formula | C6H11ClO2 |
| InChI | InChI=1S/C6H11ClO2/c1-3-4-9-6(8)5(2)7/h5H,3-4H2,1-2H3 |
| InChIKey | XVDQGLUGZORASO-UHFFFAOYSA-N |
| SMILES | CC(C(OCCC)=O)Cl |
| Spectrum/Structure Validation Score (Raman) | 0.968324 |