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1-(m-Chlorophenyl)-4-(thiopiperonylyl)piperazine

View entire compound with spectra: 1 NMR, 1 FTIR, 1 Raman, and 3 UV-Vis

1-(m-Chlorophenyl)-4-(thiopiperonylyl)piperazine
SpectraBase Compound ID GJrWMi0Ty9R
InChI InChI=1S/C18H17ClN2O2S/c19-14-2-1-3-15(11-14)20-6-8-21(9-7-20)18(24)13-4-5-16-17(10-13)23-12-22-16/h1-5,10-11H,6-9,12H2
InChIKey AGCCYFQBWLFQII-UHFFFAOYSA-N
Mol Weight 360.86 g/mol
Molecular Formula C18H17ClN2O2S
Exact Mass 360.069927 g/mol

Raman Spectrum

Raman Spectrum

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SpectraBase Spectrum ID DNCmlGfTU1y
Name 1-(m-Chlorophenyl)-4-(thiopiperonylyl)piperazine
Comments Computed using SmartSpectra Model v1.42
Copyright Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved.
Exact Mass 360.069926667 u
Formula C18H17ClN2O2S
InChI InChI=1S/C18H17ClN2O2S/c19-14-2-1-3-15(11-14)20-6-8-21(9-7-20)18(24)13-4-5-16-17(10-13)23-12-22-16/h1-5,10-11H,6-9,12H2
InChIKey AGCCYFQBWLFQII-UHFFFAOYSA-N
Molecular Weight 360.859 g/mol
SMILES C=1C(=CC(=CC1)N1CCN(CC1)C(=S)C=1C=CC=2OCOC2C1)Cl
Spectrum/Structure Validation Score (Raman) 0.983563