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4-Chlorobenzylamine N,N-bis(3-bromobenzyl)
SpectraBase Compound ID 4hHGyvqa2Z6
InChI InChI=1S/C21H18Br2ClN/c22-19-5-1-3-17(11-19)14-25(13-16-7-9-21(24)10-8-16)15-18-4-2-6-20(23)12-18/h1-12H,13-15H2
InChIKey KGKBHDHXSPBYKT-UHFFFAOYSA-N
Mol Weight 479.64 g/mol
Molecular Formula C21H18Br2ClN
Exact Mass 476.949453 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID Djp8qWGhhVg
Name 4-Chlorobenzylamine N,N-bis(3-bromobenzyl)
Classification Chemical
Copyright Copyright © 2024 DigiLab GmbH and Wiley-VCH GmbH. All Rights Reserved.
Exact Mass 476.949453284 u
Formula C21H18Br2ClN
InChI InChI=1S/C21H18Br2ClN/c22-19-5-1-3-17(11-19)14-25(13-16-7-9-21(24)10-8-16)15-18-4-2-6-20(23)12-18/h1-12H,13-15H2
InChIKey KGKBHDHXSPBYKT-UHFFFAOYSA-N
Ionization Type Electron Ionization (EI)
Molecular Weight 479.643 g/mol
Nominal Mass 477 u
Quality 996
Retention Index 3223
SMILES C(N(CC1=CC(=CC=C1)Br)CC1=CC=C(C=C1)Cl)C1=CC(=CC=C1)Br
SPLASH splash10-004i-4904000000-4e6701f9e5d93f2c88a5
Source of Spectrum DigiLab GmbH (C) 2024
Synonyms 1-(3-Bromophenyl)-N-(3-bromobenzyl)-N-[(4-chlorophenyl)methyl]methanamine
Technique GC/MS
Wiley ID DD2024_021013