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(2-Hydroxy-phenyl)-[4-(2-hydroxy-thiobenzoyl)-piperazin-1-yl]-methanethione

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

(2-Hydroxy-phenyl)-[4-(2-hydroxy-thiobenzoyl)-piperazin-1-yl]-methanethione
SpectraBase Compound ID 4BVj7XlC5x6
InChI InChI=1S/C18H18N2O2S2/c21-15-7-3-1-5-13(15)17(23)19-9-11-20(12-10-19)18(24)14-6-2-4-8-16(14)22/h1-8,21-22H,9-12H2
InChIKey LGTSXRPGGWMJOR-UHFFFAOYSA-N
Mol Weight 358.47 g/mol
Molecular Formula C18H18N2O2S2
Exact Mass 358.08097 g/mol

Vapor Phase (Gas) Infrared Spectrum

Vapor Phase (Gas) Infrared Spectrum

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SpectraBase Spectrum ID CcWpbfqa25k
Name (2-Hydroxy-phenyl)-[4-(2-hydroxy-thiobenzoyl)-piperazin-1-yl]-methanethione
Comments Computed using SmartSpectra Model v1.42
Copyright Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved.
Exact Mass 358.080970174 u
Formula C18H18N2O2S2
InChI InChI=1S/C18H18N2O2S2/c21-15-7-3-1-5-13(15)17(23)19-9-11-20(12-10-19)18(24)14-6-2-4-8-16(14)22/h1-8,21-22H,9-12H2
InChIKey LGTSXRPGGWMJOR-UHFFFAOYSA-N
Molecular Weight 358.474 g/mol
SMILES C(C1=C(O)C=CC=C1)(N1CCN(C(C2=C(O)C=CC=C2)=S)CC1)=S
Spectrum/Structure Validation Score (Vapor Phase IR) 0.928118