| SpectraBase Compound ID | LDILSFdFZxN |
|---|---|
| InChI | InChI=1S/C5H9ClO2/c1-4(6)5(7-2)8-3/h5H,1H2,2-3H3 |
| InChIKey | COZIGJOYTJGSHR-UHFFFAOYSA-N |
| Mol Weight | 136.58 g/mol |
| Molecular Formula | C5H9ClO2 |
| Exact Mass | 136.029107 g/mol |
Raman Spectrum
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| SpectraBase Spectrum ID | Ex5YSuw79PQ |
|---|---|
| Name | 1-Propene, 2-chloro-3,3-dimethoxy-; acrolein, 2-chloro-, dimethyl acetal |
| Comments | Computed using SmartSpectra Model v1.42 |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 136.029107228 u |
| Formula | C5H9ClO2 |
| InChI | InChI=1S/C5H9ClO2/c1-4(6)5(7-2)8-3/h5H,1H2,2-3H3 |
| InChIKey | COZIGJOYTJGSHR-UHFFFAOYSA-N |
| SMILES | C=C(C(OC)OC)Cl |
| Spectrum/Structure Validation Score (Raman) | 0.902581 |