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

*Links on SpectraBase are not permalinks.

N-[2-(3,4-Dimethoxyphenyl)ethyl]-2-phenylsulfanylethylamine

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

N-[2-(3,4-Dimethoxyphenyl)ethyl]-2-phenylsulfanylethylamine
SpectraBase Compound ID 3msO4phV4X7
InChI InChI=1S/C18H23NO2S/c1-20-17-9-8-15(14-18(17)21-2)10-11-19-12-13-22-16-6-4-3-5-7-16/h3-9,14,19H,10-13H2,1-2H3
InChIKey GYDDHWUJVQKFLP-UHFFFAOYSA-N
Mol Weight 317.45 g/mol
Molecular Formula C18H23NO2S
Exact Mass 317.14495 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 6tBOMYF0mUp
Name N-[2-(3,4-Dimethoxyphenyl)ethyl]-2-phenylsulfanylethylamine
Comments Computed using SmartSpectra Model v1.42
Copyright Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved.
Exact Mass 317.144950157 u
Formula C18H23NO2S
InChI InChI=1S/C18H23NO2S/c1-20-17-9-8-15(14-18(17)21-2)10-11-19-12-13-22-16-6-4-3-5-7-16/h3-9,14,19H,10-13H2,1-2H3
InChIKey GYDDHWUJVQKFLP-UHFFFAOYSA-N
Molecular Weight 317.447 g/mol
SMILES C=1(C(=CC=C(C1)CCNCCSC1=CC=CC=C1)OC)OC
Spectrum/Structure Validation Score (Vapor Phase IR) 0.938742