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4-(2-Amino-phenylthio)-1-benzyl-6-phenylpiperidin-2-thione

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

4-(2-Amino-phenylthio)-1-benzyl-6-phenylpiperidin-2-thione
SpectraBase Compound ID 4UKwWhWboDB
InChI InChI=1S/C24H24N2S2/c25-21-13-7-8-14-23(21)28-20-15-22(19-11-5-2-6-12-19)26(24(27)16-20)17-18-9-3-1-4-10-18/h1-14,20,22H,15-17,25H2
InChIKey WRYPNANBIMBCLQ-UHFFFAOYSA-N
Mol Weight 404.59 g/mol
Molecular Formula C24H24N2S2
Exact Mass 404.138091 g/mol

Vapor Phase (Gas) Infrared Spectrum

Vapor Phase (Gas) Infrared Spectrum

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SpectraBase Spectrum ID ELCfTaCfrID
Name 4-(2-Amino-phenylthio)-1-benzyl-6-phenylpiperidin-2-thione
Comments Computed using SmartSpectra Model v1.42
Copyright Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved.
Exact Mass 404.138091129 u
Formula C24H24N2S2
InChI InChI=1S/C24H24N2S2/c25-21-13-7-8-14-23(21)28-20-15-22(19-11-5-2-6-12-19)26(24(27)16-20)17-18-9-3-1-4-10-18/h1-14,20,22H,15-17,25H2
InChIKey WRYPNANBIMBCLQ-UHFFFAOYSA-N
Molecular Weight 404.590 g/mol
SMILES C1C(N(C(CC1SC1=CC=CC=C1N)C1=CC=CC=C1)CC1=CC=CC=C1)=S
Spectrum/Structure Validation Score (Vapor Phase IR) 0.944548