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N-(4-Bromobenzyl)-4-methoxy-N-[2-(thiophen-2-yl)ethyl]aniline
SpectraBase Compound ID 9NOESiXf35c
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
Mol Weight 402.35 g/mol
Molecular Formula C20H20BrNOS
Exact Mass 401.044898 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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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