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3-(3-Bromophenyl)pyrrolidine-2,5-dione, N-acetyl-

View entire compound with spectra: 1 FTIR

3-(3-Bromophenyl)pyrrolidine-2,5-dione, N-acetyl-
SpectraBase Compound ID 2jI8ABo88ZL
InChI InChI=1S/C12H10BrNO3/c1-7(15)14-11(16)6-10(12(14)17)8-3-2-4-9(13)5-8/h2-5,10H,6H2,1H3
InChIKey NQGALDQESGWMSB-UHFFFAOYSA-N
Mol Weight 296.12 g/mol
Molecular Formula C12H10BrNO3
Exact Mass 294.984406 g/mol

Vapor Phase (Gas) Infrared Spectrum

Vapor Phase (Gas) Infrared Spectrum

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SpectraBase Spectrum ID Ca8J54CJoxk
Name 3-(3-Bromophenyl)pyrrolidine-2,5-dione, N-acetyl-
Comments Computed using SmartSpectra Model v1.42
Copyright Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved.
Exact Mass 294.984406183 u
Formula C12H10BrNO3
InChI InChI=1S/C12H10BrNO3/c1-7(15)14-11(16)6-10(12(14)17)8-3-2-4-9(13)5-8/h2-5,10H,6H2,1H3
InChIKey NQGALDQESGWMSB-UHFFFAOYSA-N
Molecular Weight 296.120 g/mol
SMILES C1(Br)=CC(=CC=C1)C1CC(=O)N(C1=O)C(C)=O
Spectrum/Structure Validation Score (Vapor Phase IR) 0.941078