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N-benzyl-N-(3-iodobenzyl)ethanamine
SpectraBase Compound ID BWoLbQMDmk1
InChI InChI=1S/C16H18IN/c1-2-18(12-14-7-4-3-5-8-14)13-15-9-6-10-16(17)11-15/h3-11H,2,12-13H2,1H3
InChIKey JISICFLMXJQKKG-UHFFFAOYSA-N
Mol Weight 351.23 g/mol
Molecular Formula C16H18IN
Exact Mass 351.048395 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID GWo76JYUeAa
Name N-Benzyl-N-(3-iodobenzyl)ethanamine
Classification Chemical
Copyright Copyright © 2024 DigiLab GmbH and Wiley-VCH GmbH. All Rights Reserved.
Exact Mass 351.048394584 u
Formula C16H18IN
InChI InChI=1S/C16H18IN/c1-2-18(12-14-7-4-3-5-8-14)13-15-9-6-10-16(17)11-15/h3-11H,2,12-13H2,1H3
InChIKey JISICFLMXJQKKG-UHFFFAOYSA-N
Ionization Type Electron Ionization (EI)
Molecular Weight 351.231 g/mol
Nominal Mass 351 u
Quality 978
Retention Index 2090
SMILES C1(CN(CC2=CC=CC=C2)CC)=CC(=CC=C1)I
SPLASH splash10-000l-9117000000-7440b67a229faa95ecf0
Source of Spectrum DigiLab GmbH (C) 2024
Synonyms N-benzyl-N-(3-iodobenzyl)ethanamine
Technique GC/MS
Wiley ID DD2024_020453