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N-(2-Fluorobenzyl)azepane
SpectraBase Compound ID G6Zt7OMkPEx
InChI InChI=1S/C13H18FN/c14-13-8-4-3-7-12(13)11-15-9-5-1-2-6-10-15/h3-4,7-8H,1-2,5-6,9-11H2
InChIKey BWEXQNMZSQNIDU-UHFFFAOYSA-N
Mol Weight 207.29 g/mol
Molecular Formula C13H18FN
Exact Mass 207.142328 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 5VZ2rln6VPs
Name N-(2-Fluorobenzyl)azepane
Classification Chemical
Copyright Copyright © 2024 DigiLab GmbH and Wiley-VCH GmbH. All Rights Reserved.
Exact Mass 207.142327747 u
Formula C13H18FN
InChI InChI=1S/C13H18FN/c14-13-8-4-3-7-12(13)11-15-9-5-1-2-6-10-15/h3-4,7-8H,1-2,5-6,9-11H2
InChIKey BWEXQNMZSQNIDU-UHFFFAOYSA-N
Ionization Type Electron Ionization (EI)
Molecular Weight 207.292 g/mol
Nominal Mass 207 u
Quality 968
Retention Index 1558
SMILES C=1(C(=CC=CC1)F)CN1CCCCCC1
SPLASH splash10-0a4i-3930000000-2608af2cddac70a910db
Source of Spectrum DigiLab GmbH (C) 2024
Synonyms 1H-Azepine,1-[(2-fluorophenyl)methyl]hexahydro- 1-(2-Fluorobenzyl)azepane
Technique GC/MS
Wiley ID DD2024_013214