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5-(dimethylamino)-3,4-diphenyl-1,3-thiazole-2(3H)-thione

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

5-(dimethylamino)-3,4-diphenyl-1,3-thiazole-2(3H)-thione
SpectraBase Compound ID GHRgeBAwzuF
InChI InChI=1S/C17H16N2S2/c1-18(2)16-15(13-9-5-3-6-10-13)19(17(20)21-16)14-11-7-4-8-12-14/h3-12H,1-2H3
InChIKey TXUIQUHLDSMOIU-UHFFFAOYSA-N
Mol Weight 312.45 g/mol
Molecular Formula C17H16N2S2
Exact Mass 312.075491 g/mol

Vapor Phase (Gas) Infrared Spectrum

Vapor Phase (Gas) Infrared Spectrum

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SpectraBase Spectrum ID 9337Edj6C0d
Name 5-(Dimethylamino)-3,4-diphenyl-1,3-thiazole-2(3H)-thione
Comments Computed using SmartSpectra Model v1.42
Copyright Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved.
Exact Mass 312.075490871 u
Formula C17H16N2S2
InChI InChI=1S/C17H16N2S2/c1-18(2)16-15(13-9-5-3-6-10-13)19(17(20)21-16)14-11-7-4-8-12-14/h3-12H,1-2H3
InChIKey TXUIQUHLDSMOIU-UHFFFAOYSA-N
Molecular Weight 312.449 g/mol
SMILES C=1(SC(=S)N(C1C=1C=CC=CC1)C1=CC=CC=C1)N(C)C
Spectrum/Structure Validation Score (Vapor Phase IR) 0.908729