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N-Methyl-N-[(p-tolylsulfonyl)methyl]aniline

View entire compound with spectra: 3 NMR, 1 FTIR, and 1 MS (GC)

N-Methyl-N-[(p-tolylsulfonyl)methyl]aniline
SpectraBase Compound ID GsQSrpLLqJF
InChI InChI=1S/C15H17NO2S/c1-13-8-10-15(11-9-13)19(17,18)12-16(2)14-6-4-3-5-7-14/h3-11H,12H2,1-2H3
InChIKey QSAMRTGROFVOGX-UHFFFAOYSA-N
Mol Weight 275.37 g/mol
Molecular Formula C15H17NO2S
Exact Mass 275.098 g/mol

Vapor Phase (Gas) Infrared Spectrum

Vapor Phase (Gas) Infrared Spectrum

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SpectraBase Spectrum ID Jw8O3rRNLnI
Name N-Methyl-N-[(p-tolylsulfonyl)methyl]aniline
Comments Computed using SmartSpectra Model v1.42
Copyright Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved.
Exact Mass 275.097999963 u
Formula C15H17NO2S
InChI InChI=1S/C15H17NO2S/c1-13-8-10-15(11-9-13)19(17,18)12-16(2)14-6-4-3-5-7-14/h3-11H,12H2,1-2H3
InChIKey QSAMRTGROFVOGX-UHFFFAOYSA-N
SMILES C=1C(=CC=C(C1)C)S(=O)(=O)CN(C=1C=CC=CC1)C
Spectrum/Structure Validation Score (Vapor Phase IR) 0.881801