| SpectraBase Compound ID | 2fqF6PP6Yvy |
|---|---|
| InChI | InChI=1S/C6H10Cl2O3/c1-4(3-10-2)11-6(9)5(7)8/h4-5H,3H2,1-2H3 |
| InChIKey | NITFBCWOVAPXRK-UHFFFAOYSA-N |
| Mol Weight | 201.05 g/mol |
| Molecular Formula | C6H10Cl2O3 |
| Exact Mass | 200.0007 g/mol |
Raman Spectrum
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| SpectraBase Spectrum ID | AD2A6WMmRa9 |
|---|---|
| Name | Acetic acid, dichloro-, 2-methoxy- 1-methylethyl ester |
| Comments | Computed using SmartSpectra Model v1.42 |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 200.000699579 u |
| Formula | C6H10Cl2O3 |
| InChI | InChI=1S/C6H10Cl2O3/c1-4(3-10-2)11-6(9)5(7)8/h4-5H,3H2,1-2H3 |
| InChIKey | NITFBCWOVAPXRK-UHFFFAOYSA-N |
| SMILES | C(C(OC(C(Cl)Cl)=O)C)OC |
| Spectrum/Structure Validation Score (Raman) | 0.847731 |