For citations & permissions, please see: Citations & Permissions - Wiley Science Solutions*

*Links on SpectraBase are not permalinks.

4-Methoxy-N-(2-benzylsulfonylethyl)aniline

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

4-Methoxy-N-(2-benzylsulfonylethyl)aniline
SpectraBase Compound ID 8fIWH87Gfgw
InChI InChI=1S/C16H19NO3S/c1-20-16-9-7-15(8-10-16)17-11-12-21(18,19)13-14-5-3-2-4-6-14/h2-10,17H,11-13H2,1H3
InChIKey MPFIDMAKHWAGPU-UHFFFAOYSA-N
Mol Weight 305.39 g/mol
Molecular Formula C16H19NO3S
Exact Mass 305.108565 g/mol

Vapor Phase (Gas) Infrared Spectrum

Vapor Phase (Gas) Infrared Spectrum

View the Full Spectrum for FREE!

The full spectrum can only be viewed using a FREE account.

SpectraBase Spectrum ID FnFhYIURp6S
Name 4-Methoxy-N-(2-benzylsulfonylethyl)aniline
Comments Computed using SmartSpectra Model v1.42
Copyright Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved.
Exact Mass 305.108564647 u
Formula C16H19NO3S
InChI InChI=1S/C16H19NO3S/c1-20-16-9-7-15(8-10-16)17-11-12-21(18,19)13-14-5-3-2-4-6-14/h2-10,17H,11-13H2,1H3
InChIKey MPFIDMAKHWAGPU-UHFFFAOYSA-N
Molecular Weight 305.392 g/mol
SMILES C=1(NCCS(=O)(=O)CC=2C=CC=CC2)C=CC(=CC1)OC
Spectrum/Structure Validation Score (Vapor Phase IR) 0.92413