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2,2-Diphenyl-N-methylthiolane-3,4-dicarboximide

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

2,2-Diphenyl-N-methylthiolane-3,4-dicarboximide
SpectraBase Compound ID Ig489KxsDOY
InChI InChI=1S/C19H17NO2S/c1-20-17(21)15-12-23-19(16(15)18(20)22,13-8-4-2-5-9-13)14-10-6-3-7-11-14/h2-11,15-16H,12H2,1H3
InChIKey REPDATPVQMNACA-UHFFFAOYSA-N
Mol Weight 323.41 g/mol
Molecular Formula C19H17NO2S
Exact Mass 323.098 g/mol

Vapor Phase (Gas) Infrared Spectrum

Vapor Phase (Gas) Infrared Spectrum

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SpectraBase Spectrum ID HWH4hGEBp86
Name 2,2-Diphenyl-N-methylthiolane-3,4-dicarboximide
Comments Computed using SmartSpectra Model v1.42
Copyright Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved.
Exact Mass 323.097999963 u
Formula C19H17NO2S
InChI InChI=1S/C19H17NO2S/c1-20-17(21)15-12-23-19(16(15)18(20)22,13-8-4-2-5-9-13)14-10-6-3-7-11-14/h2-11,15-16H,12H2,1H3
InChIKey REPDATPVQMNACA-UHFFFAOYSA-N
Molecular Weight 323.410 g/mol
SMILES C12C(N(C)C(C2CSC1(C1=CC=CC=C1)C=1C=CC=CC1)=O)=O
Spectrum/Structure Validation Score (Vapor Phase IR) 0.916486