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3-Fluorobenzylamine N,N-bis(3-bromobenzyl)
SpectraBase Compound ID CPjwVVUTp6V
InChI InChI=1S/C21H18Br2FN/c22-19-7-1-4-16(10-19)13-25(14-17-5-2-8-20(23)11-17)15-18-6-3-9-21(24)12-18/h1-12H,13-15H2
InChIKey AISJARNLMLXLJC-UHFFFAOYSA-N
Mol Weight 463.19 g/mol
Molecular Formula C21H18Br2FN
Exact Mass 460.979004 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 2mgiEGoRCjY
Name 3-Fluorobenzylamine N,N-bis(3-bromobenzyl)
Classification Chemical
Comments Spectrum verified by independent measurements in external laboratories
Copyright Copyright © 2024 DigiLab GmbH and Wiley-VCH GmbH. All Rights Reserved.
Exact Mass 460.979003747 u
Formula C21H18Br2FN
InChI InChI=1S/C21H18Br2FN/c22-19-7-1-4-16(10-19)13-25(14-17-5-2-8-20(23)11-17)15-18-6-3-9-21(24)12-18/h1-12H,13-15H2
InChIKey AISJARNLMLXLJC-UHFFFAOYSA-N
Ionization Type Electron Ionization (EI)
Molecular Weight 463.188 g/mol
Nominal Mass 461 u
Quality 860
Retention Index 3150
SMILES C(N(CC=1C=C(C=CC1)Br)CC1=CC(=CC=C1)Br)C=1C=C(C=CC1)F
SPLASH splash10-052f-3932100000-cf79b3cb8f19d5642f7f
Source of Spectrum DigiLab GmbH (C) 2024
Synonyms 1-(3-Bromophenyl)-N-(3-bromobenzyl)-N-[(3-fluorophenyl)methyl]methanamine
Technique GC/MS
Wiley ID DD2024_020442