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1-(4-Chlorophenyl)-N-[2-(4-tert-butyl-2,5-dimethoxyphenyl)ethyl]methanimine
SpectraBase Compound ID P5igSPhTe6
InChI InChI=1S/C21H26ClNO2/c1-21(2,3)18-13-19(24-4)16(12-20(18)25-5)10-11-23-14-15-6-8-17(22)9-7-15/h6-9,12-14H,10-11H2,1-5H3/b23-14+
InChIKey PDCQGJULVCLYQW-OEAKJJBVSA-N
Mol Weight 359.9 g/mol
Molecular Formula C21H26ClNO2
Exact Mass 359.165207 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 8IZYa7snswa
Name 1-(4-Chlorophenyl)-N-[2-(4-tert-butyl-2,5-dimethoxyphenyl)ethyl]methanimine
Classification Designer drug artifact
Copyright Copyright © 2024 DigiLab GmbH and Wiley-VCH GmbH. All Rights Reserved.
Exact Mass 359.165206779 u
Formula C21H26ClNO2
InChI InChI=1S/C21H26ClNO2/c1-21(2,3)18-13-19(24-4)16(12-20(18)25-5)10-11-23-14-15-6-8-17(22)9-7-15/h6-9,12-14H,10-11H2,1-5H3/b23-14+
InChIKey PDCQGJULVCLYQW-OEAKJJBVSA-N
Ionization Type Electron Ionization (EI)
Molecular Weight 359.897 g/mol
Nominal Mass 359 u
Quality 990
Retention Index 2490
SMILES C1(=C(C=C(C(=C1)OC)CC\N=C\C=1C=CC(=CC1)Cl)OC)C(C)(C)C
SPLASH splash10-056r-2945000000-c18483beac0dccffa155
Sample Comments cis/trans isomerism uncertain
Source of Spectrum DigiLab GmbH (C) 2024
Synonyms N-(2-(4-tert-butyl-2,5-dimethoxyphenyl)ethyl)(4-chlorophenyl)methanimine
Technique GC/MS
Wiley ID DD2024_020680