SpectraBase Spectrum ID |
8GHysqJb6K8 |
Name |
N-(4-Bromobenzyl)-4-methoxy-N-[2-(thiophen-2-yl)ethyl]aniline |
Classification |
Chemical |
Copyright |
Copyright © 2024 DigiLab GmbH and Wiley-VCH GmbH. All Rights Reserved. |
Exact Mass |
401.044898441 u |
Formula |
C20H20BrNOS |
InChI |
InChI=1S/C20H20BrNOS/c1-23-19-10-8-18(9-11-19)22(13-12-20-3-2-14-24-20)15-16-4-6-17(21)7-5-16/h2-11,14H,12-13,15H2,1H3 |
InChIKey |
JMJYQNDFOOOGFD-UHFFFAOYSA-N |
Ionization Type |
Electron Ionization (EI) |
Molecular Weight |
402.350 g/mol |
Nominal Mass |
401 u |
Quality |
851 |
Retention Index |
3195 |
SMILES |
C1(N(CC2=CC=C(C=C2)Br)CCC=2SC=CC2)=CC=C(C=C1)OC |
SPLASH |
splash10-0pb9-0409000000-632bd6e6c6a5951da63f |
Source of Spectrum |
DigiLab GmbH (C) 2024 |
Technique |
GC/MS |
Wiley ID |
DD2024_026865 |