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1-(3-Bromophenyl)-2-(piperazin-1-yl)propan-1-one

View entire compound with spectra: 1 FTIR

1-(3-Bromophenyl)-2-(piperazin-1-yl)propan-1-one
SpectraBase Compound ID IBKeECubtG0
InChI InChI=1S/C13H17BrN2O/c1-10(16-7-5-15-6-8-16)13(17)11-3-2-4-12(14)9-11/h2-4,9-10,15H,5-8H2,1H3
InChIKey ZQZGNVGSHBPBMS-UHFFFAOYSA-N
Mol Weight 297.2 g/mol
Molecular Formula C13H17BrN2O
Exact Mass 296.052426 g/mol

Vapor Phase (Gas) Infrared Spectrum

Vapor Phase (Gas) Infrared Spectrum

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SpectraBase Spectrum ID FededQm8dXu
Name 1-(3-Bromophenyl)-2-(piperazin-1-yl)propan-1-one
Comments Computed using SmartSpectra Model v1.42
Copyright Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved.
Exact Mass 296.052426174 u
Formula C13H17BrN2O
InChI InChI=1S/C13H17BrN2O/c1-10(16-7-5-15-6-8-16)13(17)11-3-2-4-12(14)9-11/h2-4,9-10,15H,5-8H2,1H3
InChIKey ZQZGNVGSHBPBMS-UHFFFAOYSA-N
SMILES C1(=CC=CC(=C1)C(C(N1CCNCC1)C)=O)Br
Spectrum/Structure Validation Score (Vapor Phase IR) 0.88403