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N.N-Bis(4-chlorobenzyl)-4-bromophenethylamine
SpectraBase Compound ID Kn6i18JXEmf
InChI InChI=1S/C22H20BrCl2N/c23-20-7-1-17(2-8-20)13-14-26(15-18-3-9-21(24)10-4-18)16-19-5-11-22(25)12-6-19/h1-12H,13-16H2
InChIKey ICDFRBLWSDJRDC-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 3rPlJfXKYZI
Name N.N-Bis(4-chlorobenzyl)-4-bromophenethylamine
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/c23-20-7-1-17(2-8-20)13-14-26(15-18-3-9-21(24)10-4-18)16-19-5-11-22(25)12-6-19/h1-12H,13-16H2
InChIKey ICDFRBLWSDJRDC-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(CCC1=CC=C(C=C1)Br)CC=1C=CC(=CC1)Cl)C=1C=CC(=CC1)Cl
SPLASH splash10-004i-2890000000-e6c9473710e5696b4b19
Source of Spectrum DigiLab GmbH (C) 2024
Synonyms N.N-Bis(4-chlorobenzyl)-4-bromobenzeneethanamine 2-(4-bromophenyl)-N,N-bis(4-chlorobenzyl)ethan-1-amine
Technique GC/MS
Wiley ID DD2024_021758