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2-(Benzhydrylthio)ethanethiol

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

2-(Benzhydrylthio)ethanethiol
SpectraBase Compound ID 9Il48MZ0uMi
InChI InChI=1S/C15H16S2/c16-11-12-17-15(13-7-3-1-4-8-13)14-9-5-2-6-10-14/h1-10,15-16H,11-12H2
InChIKey JUHMSBSITSNFFN-UHFFFAOYSA-N
Mol Weight 260.41 g/mol
Molecular Formula C15H16S2
Exact Mass 260.069343 g/mol

Vapor Phase (Gas) Infrared Spectrum

Vapor Phase (Gas) Infrared Spectrum

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SpectraBase Spectrum ID 2yu4I7pbBYm
Name 2-(Benzhydrylthio)ethanethiol
Comments Computed using SmartSpectra Model v1.42
Copyright Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved.
Exact Mass 260.069342863 u
Formula C15H16S2
InChI InChI=1S/C15H16S2/c16-11-12-17-15(13-7-3-1-4-8-13)14-9-5-2-6-10-14/h1-10,15-16H,11-12H2
InChIKey JUHMSBSITSNFFN-UHFFFAOYSA-N
Molecular Weight 260.413 g/mol
SMILES C(C1=CC=CC=C1)(C=1C=CC=CC1)SCCS
Spectrum/Structure Validation Score (Vapor Phase IR) 0.94613