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(E)-2-(4-Bromophenyl)methylenecyclobutanone

View entire compound with spectra: 1 FTIR, and 1 MS (GC)

(E)-2-(4-Bromophenyl)methylenecyclobutanone
SpectraBase Compound ID JVzUfp3O4t
InChI InChI=1S/C11H9BrO/c12-10-4-1-8(2-5-10)7-9-3-6-11(9)13/h1-2,4-5,7H,3,6H2/b9-7+
InChIKey XAFROQGNWCHWCV-VQHVLOKHSA-N
Mol Weight 237.1 g/mol
Molecular Formula C11H9BrO
Exact Mass 235.983678 g/mol

Vapor Phase (Gas) Infrared Spectrum

Vapor Phase (Gas) Infrared Spectrum

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SpectraBase Spectrum ID 39AESo0abXI
Name (E)-2-(4-Bromophenyl)methylenecyclobutanone
Comments Computed using SmartSpectra Model v1.42
Copyright Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved.
Exact Mass 235.983677909 u
Formula C11H9BrO
InChI InChI=1S/C11H9BrO/c12-10-4-1-8(2-5-10)7-9-3-6-11(9)13/h1-2,4-5,7H,3,6H2/b9-7+
InChIKey XAFROQGNWCHWCV-VQHVLOKHSA-N
Molecular Weight 237.096 g/mol
SMILES C=1(\C=C\2C(CC2)=O)C=CC(=CC1)Br
Spectrum/Structure Validation Score (Vapor Phase IR) 0.958233