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1-(4-Chlorophenyl)-2-(piperazin-1-yl)propan-1-one

View entire compound with spectra: 1 FTIR

1-(4-Chlorophenyl)-2-(piperazin-1-yl)propan-1-one
SpectraBase Compound ID KrzG3q1MeSc
InChI InChI=1S/C13H17ClN2O/c1-10(16-8-6-15-7-9-16)13(17)11-2-4-12(14)5-3-11/h2-5,10,15H,6-9H2,1H3
InChIKey HCPFDXFUHFJWFV-UHFFFAOYSA-N
Mol Weight 252.74 g/mol
Molecular Formula C13H17ClN2O
Exact Mass 252.102941 g/mol

Vapor Phase (Gas) Infrared Spectrum

Vapor Phase (Gas) Infrared Spectrum

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SpectraBase Spectrum ID JBFxLzNqNJO
Name 1-(4-Chlorophenyl)-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 252.102940874 u
Formula C13H17ClN2O
InChI InChI=1S/C13H17ClN2O/c1-10(16-8-6-15-7-9-16)13(17)11-2-4-12(14)5-3-11/h2-5,10,15H,6-9H2,1H3
InChIKey HCPFDXFUHFJWFV-UHFFFAOYSA-N
Molecular Weight 252.745 g/mol
SMILES C1=C(C=CC(=C1)C(C(N1CCNCC1)C)=O)Cl
Spectrum/Structure Validation Score (Vapor Phase IR) 0.93076