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N-benzyl-3-chloropyrrolidine-2,5-dione

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N-benzyl-3-chloropyrrolidine-2,5-dione
SpectraBase Compound ID AmAH7m1iNZk
InChI InChI=1S/C11H10ClNO2/c12-9-6-10(14)13(11(9)15)7-8-4-2-1-3-5-8/h1-5,9H,6-7H2
InChIKey BGZGIFXIMUOIHS-UHFFFAOYSA-N
Mol Weight 223.66 g/mol
Molecular Formula C11H10ClNO2
Exact Mass 223.040006 g/mol

Vapor Phase (Gas) Infrared Spectrum

Vapor Phase (Gas) Infrared Spectrum

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SpectraBase Spectrum ID 5IfgdU2GsGf
Name N-Benzyl-3-chloropyrrolidine-2,5-dione
Comments Computed using SmartSpectra Model v1.42
Copyright Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved.
Exact Mass 223.040006264 u
Formula C11H10ClNO2
InChI InChI=1S/C11H10ClNO2/c12-9-6-10(14)13(11(9)15)7-8-4-2-1-3-5-8/h1-5,9H,6-7H2
InChIKey BGZGIFXIMUOIHS-UHFFFAOYSA-N
Molecular Weight 223.659 g/mol
SMILES C1(N(C(C(C1)Cl)=O)CC=1C=CC=CC1)=O
Spectrum/Structure Validation Score (Vapor Phase IR) 0.948822