SpectraBase Compound ID | JqtdQnS0nKB |
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InChI | InChI=1S/C9H9ClO2/c10-8-4-2-1-3-7(8)9-11-5-6-12-9/h1-4,9H,5-6H2 |
InChIKey | GAZHHIWZNZPXQM-UHFFFAOYSA-N |
Mol Weight | 184.62 g/mol |
Molecular Formula | C9H9ClO2 |
Exact Mass | 184.029107 g/mol |
SpectraBase Spectrum ID | ChFyLY5nxiA |
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Name | 2-(o-Chlorophenyl)-1,3-dioxolane |
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/c10-8-4-2-1-3-7(8)9-11-5-6-12-9/h1-4,9H,5-6H2 |
InChIKey | GAZHHIWZNZPXQM-UHFFFAOYSA-N |
Molecular Weight | 184.622 g/mol |
SMILES | C1=C(C(=CC=C1)C1OCCO1)Cl |
Spectrum/Structure Validation Score (Raman) | 0.983506 |