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N-Phenyl-3,4-dihydro-2H-quinoline-1-carbothioamide

View entire compound with spectra: 1 NMR, and 1 FTIR

N-Phenyl-3,4-dihydro-2H-quinoline-1-carbothioamide
SpectraBase Compound ID BA2vgFCvADk
InChI InChI=1S/C16H16N2S/c19-16(17-14-9-2-1-3-10-14)18-12-6-8-13-7-4-5-11-15(13)18/h1-5,7,9-11H,6,8,12H2,(H,17,19)
InChIKey SUWCZYTUBWQYIU-UHFFFAOYSA-N
Mol Weight 268.38 g/mol
Molecular Formula C16H16N2S
Exact Mass 268.10342 g/mol

Vapor Phase (Gas) Infrared Spectrum

Vapor Phase (Gas) Infrared Spectrum

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SpectraBase Spectrum ID 3YWnEoyatRv
Name N-Phenyl-3,4-dihydro-2H-quinoline-1-carbothioamide
Comments Computed using SmartSpectra Model v1.42
Copyright Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved.
Exact Mass 268.103419697 u
Formula C16H16N2S
InChI InChI=1S/C16H16N2S/c19-16(17-14-9-2-1-3-10-14)18-12-6-8-13-7-4-5-11-15(13)18/h1-5,7,9-11H,6,8,12H2,(H,17,19)
InChIKey SUWCZYTUBWQYIU-UHFFFAOYSA-N
SMILES C1CCC=2C(N1C(=S)NC1=CC=CC=C1)=CC=CC2
Spectrum/Structure Validation Score (Vapor Phase IR) 0.938011