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1-(2,4-Dichlorobenzoyl)-2-pyrrolidinone
SpectraBase Compound ID DOHBzl5I3EA
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

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID 9MG3fkuMsUK
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