SpectraBase Compound ID | FAgRlzzmNWp |
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InChI | InChI=1S/C12H8Cl2O/c13-9-6-7-11(14)12(8-9)15-10-4-2-1-3-5-10/h1-8H |
InChIKey | VITXVDNQHXYQSK-UHFFFAOYSA-N |
Mol Weight | 239.1 g/mol |
Molecular Formula | C12H8Cl2O |
Exact Mass | 237.99522 g/mol |
SpectraBase Spectrum ID | 8Mq6Q6vj30j |
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Name | 2,5-Dichlorodiphenylether |
Comments | Computed using SmartSpectra Model v1.42 |
Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
Exact Mass | 237.995220277 u |
Formula | C12H8Cl2O |
InChI | InChI=1S/C12H8Cl2O/c13-9-6-7-11(14)12(8-9)15-10-4-2-1-3-5-10/h1-8H |
InChIKey | VITXVDNQHXYQSK-UHFFFAOYSA-N |
Molecular Weight | 239.101 g/mol |
SMILES | C1(OC2=CC=CC=C2)=C(Cl)C=CC(Cl)=C1 |
Spectrum/Structure Validation Score (Vapor Phase IR) | 0.923983 |