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N-[[2-p-Tolylsulfonyl]ethyl]phthalimide

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

N-[[2-p-Tolylsulfonyl]ethyl]phthalimide
SpectraBase Compound ID 8JJockqtl84
InChI InChI=1S/C17H15NO4S/c1-12-6-8-13(9-7-12)23(21,22)11-10-18-16(19)14-4-2-3-5-15(14)17(18)20/h2-9H,10-11H2,1H3
InChIKey KMRVFKDUMGPCRO-UHFFFAOYSA-N
Mol Weight 329.37 g/mol
Molecular Formula C17H15NO4S
Exact Mass 329.072179 g/mol

Vapor Phase (Gas) Infrared Spectrum

Vapor Phase (Gas) Infrared Spectrum

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SpectraBase Spectrum ID 2JLJ5SK5ZPa
Name N-[[2-p-Tolylsulfonyl]ethyl]phthalimide
Comments Computed using SmartSpectra Model v1.42
Copyright Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved.
Exact Mass 329.072179137 u
Formula C17H15NO4S
InChI InChI=1S/C17H15NO4S/c1-12-6-8-13(9-7-12)23(21,22)11-10-18-16(19)14-4-2-3-5-15(14)17(18)20/h2-9H,10-11H2,1H3
InChIKey KMRVFKDUMGPCRO-UHFFFAOYSA-N
Molecular Weight 329.370 g/mol
SMILES CC1=CC=C(C=C1)S(=O)(=O)CCN1C(=O)C2=CC=CC=C2C1=O
Spectrum/Structure Validation Score (Vapor Phase IR) 0.920515