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1-(3-Bromobenzyl)azepane
SpectraBase Compound ID 24KnZsMJEK
InChI InChI=1S/C13H18BrN/c14-13-7-5-6-12(10-13)11-15-8-3-1-2-4-9-15/h5-7,10H,1-4,8-9,11H2
InChIKey ZISKEZUFLBKFEK-UHFFFAOYSA-N
Mol Weight 268.2 g/mol
Molecular Formula C13H18BrN
Exact Mass 267.062263 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID GYtkWv95NxI
Name 1-(3-Bromobenzyl)azepane
Classification Chemical
Copyright Copyright © 2024 DigiLab GmbH and Wiley-VCH GmbH. All Rights Reserved.
Exact Mass 267.062262584 u
Formula C13H18BrN
InChI InChI=1S/C13H18BrN/c14-13-7-5-6-12(10-13)11-15-8-3-1-2-4-9-15/h5-7,10H,1-4,8-9,11H2
InChIKey ZISKEZUFLBKFEK-UHFFFAOYSA-N
Ionization Type Electron Ionization (EI)
Molecular Weight 268.198 g/mol
Nominal Mass 267 u
Quality 904
Retention Index 1800
SMILES C=1(CN2CCCCCC2)C=C(C=CC1)Br
SPLASH splash10-014i-5590000000-7e97544de24871cd71d5
Source of Spectrum DigiLab GmbH (C) 2024
Synonyms 1-(3-Bromobenzyl)hexamethyleneimine
Technique GC/MS
Wiley ID DD2024_013160