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1-Oxo-N-phenyl-1,2,3,4-tetrahydronaphthalene-2-carbothioamide

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

1-Oxo-N-phenyl-1,2,3,4-tetrahydronaphthalene-2-carbothioamide
SpectraBase Compound ID IZ7pNJ4IRQ8
InChI InChI=1S/C17H15NOS/c19-16-14-9-5-4-6-12(14)10-11-15(16)17(20)18-13-7-2-1-3-8-13/h1-9,15H,10-11H2,(H,18,20)
InChIKey GOVMFNBJMWMYGB-UHFFFAOYSA-N
Mol Weight 281.37 g/mol
Molecular Formula C17H15NOS
Exact Mass 281.087435 g/mol

Vapor Phase (Gas) Infrared Spectrum

Vapor Phase (Gas) Infrared Spectrum

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SpectraBase Spectrum ID 5YPZ3PWfvMJ
Name 1-oxo-N-Phenyl-1,2,3,4-tetrahydronaphthalene-2-carbothioamide
Comments Computed using SmartSpectra Model v1.42
Copyright Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved.
Exact Mass 281.087435280 u
Formula C17H15NOS
InChI InChI=1S/C17H15NOS/c19-16-14-9-5-4-6-12(14)10-11-15(16)17(20)18-13-7-2-1-3-8-13/h1-9,15H,10-11H2,(H,18,20)
InChIKey GOVMFNBJMWMYGB-UHFFFAOYSA-N
SMILES C1(C(NC2=CC=CC=C2)=S)CCC2=CC=CC=C2C1=O
Spectrum/Structure Validation Score (Vapor Phase IR) 0.879069