SpectraBase Compound ID | DOHBzl5I3EA |
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InChI | InChI=1S/C11H9Cl2NO2/c12-7-3-4-8(9(13)6-7)11(16)14-5-1-2-10(14)15/h3-4,6H,1-2,5H2 |
InChIKey | REMHEFNIMRYCNC-UHFFFAOYSA-N |
Mol Weight | 258.1 g/mol |
Molecular Formula | C11H9Cl2NO2 |
Exact Mass | 257.001034 g/mol |
SpectraBase Spectrum ID | 9MG3fkuMsUK |
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Name | 1-(2,4-Dichlorobenzoyl)-2-pyrrolidinone |
Comments | Computed using HOSE algorithm |
Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
Exact Mass | 257.001033932 u |
Formula | C11H9Cl2NO2 |
InChI | InChI=1S/C11H9Cl2NO2/c12-7-3-4-8(9(13)6-7)11(16)14-5-1-2-10(14)15/h3-4,6H,1-2,5H2 |
InChIKey | REMHEFNIMRYCNC-UHFFFAOYSA-N |
SMILES | C1CN(C(C2=C(C=C(C=C2)Cl)Cl)=O)C(=O)C1 |