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N.N-Bis(4-chlorobenzyl)-4-bromo-alpha-phenethylamine
SpectraBase Compound ID FSEKXSD1Q9n
InChI InChI=1S/C22H20BrCl2N/c1-16(19-6-8-20(23)9-7-19)26(14-17-2-10-21(24)11-3-17)15-18-4-12-22(25)13-5-18/h2-13,16H,14-15H2,1H3
InChIKey MXSMQTCDIJGWOL-UHFFFAOYSA-N
Mol Weight 449.22 g/mol
Molecular Formula C22H20BrCl2N
Exact Mass 447.015618 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 8Jgcxr0LIPo
Name N.N-Bis(4-chlorobenzyl)-4-bromo-alpha-phenethylamine
Classification Chemical
Copyright Copyright © 2024 DigiLab GmbH and Wiley-VCH GmbH. All Rights Reserved.
Exact Mass 447.015618048 u
Formula C22H20BrCl2N
InChI InChI=1S/C22H20BrCl2N/c1-16(19-6-8-20(23)9-7-19)26(14-17-2-10-21(24)11-3-17)15-18-4-12-22(25)13-5-18/h2-13,16H,14-15H2,1H3
InChIKey MXSMQTCDIJGWOL-UHFFFAOYSA-N
Ionization Type Electron Ionization (EI)
Molecular Weight 449.219 g/mol
Nominal Mass 447 u
Quality 998
Retention Index 3127
SMILES C(N(CC1=CC=C(C=C1)Cl)CC=1C=CC(=CC1)Cl)(C1=CC=C(C=C1)Br)C
SPLASH splash10-0059-1900600000-9320c5a07ec52b5eb111
Source of Spectrum DigiLab GmbH (C) 2024
Synonyms N.N-Bis(4-chlorobenzyl)-4-bromo-alpha-benzeneethanamine N.N-Bis(4-chlorobenzyl)-1-(4-bromophenyl)ethylamine
Technique GC/MS
Wiley ID DD2024_021754