SpectraBase Compound ID | 2kPqtSGbW8O |
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InChI | InChI=1S/C9H9ClO2/c1-12-8-4-2-3-7(5-8)6-9(10)11/h2-5H,6H2,1H3 |
InChIKey | UZUYKYNVSJTWEH-UHFFFAOYSA-N |
Mol Weight | 184.62 g/mol |
Molecular Formula | C9H9ClO2 |
Exact Mass | 184.029107 g/mol |
SpectraBase Spectrum ID | 5Wio0umfDgD |
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Name | 3-Methoxyphenylacetyl chloride |
Comments | Computed using SmartSpectra Model v1.42 |
Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
Exact Mass | 184.029107228 u |
Formula | C9H9ClO2 |
InChI | InChI=1S/C9H9ClO2/c1-12-8-4-2-3-7(5-8)6-9(10)11/h2-5H,6H2,1H3 |
InChIKey | UZUYKYNVSJTWEH-UHFFFAOYSA-N |
Molecular Weight | 184.622 g/mol |
SMILES | COC1=CC(=CC=C1)CC(=O)Cl |
Spectrum/Structure Validation Score (Raman) | 0.982725 |