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N-Hexyl-(3-iodobenzyl)amine
SpectraBase Compound ID 1PNIDQq5UbW
InChI InChI=1S/C13H20IN/c1-2-3-4-5-9-15-11-12-7-6-8-13(14)10-12/h6-8,10,15H,2-5,9,11H2,1H3
InChIKey ASKVQZJWJSITTD-UHFFFAOYSA-N
Mol Weight 317.21 g/mol
Molecular Formula C13H20IN
Exact Mass 317.064045 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID DnmYnCKQKdE
Name N-Hexyl-(3-iodobenzyl)amine
Classification Chemical
Copyright Copyright © 2024 DigiLab GmbH and Wiley-VCH GmbH. All Rights Reserved.
Exact Mass 317.064044648 u
Formula C13H20IN
InChI InChI=1S/C13H20IN/c1-2-3-4-5-9-15-11-12-7-6-8-13(14)10-12/h6-8,10,15H,2-5,9,11H2,1H3
InChIKey ASKVQZJWJSITTD-UHFFFAOYSA-N
Ionization Type Electron Ionization (EI)
Molecular Weight 317.214 g/mol
Nominal Mass 317 u
Quality 924
Retention Index 1916
SMILES C=1(CNCCCCCC)C=C(C=CC1)I
SPLASH splash10-00kb-2190000000-505989cc4adbb35028c4
Source of Spectrum DigiLab GmbH (C) 2024
Synonyms [(3-Iodophenyl)methyl]hexanamine
Technique GC/MS
Wiley ID DD2024_013467