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N-Methyl-N-3-iodobenzyl-4-chloroaniline
SpectraBase Compound ID dQpfRCZ52P
InChI InChI=1S/C14H13ClIN/c1-17(14-7-5-12(15)6-8-14)10-11-3-2-4-13(16)9-11/h2-9H,10H2,1H3
InChIKey OXEMMSGGAIWWNQ-UHFFFAOYSA-N
Mol Weight 357.62 g/mol
Molecular Formula C14H13ClIN
Exact Mass 356.978122 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID QRDoPLA1o
Name N-Methyl-N-3-iodobenzyl-4-chloroaniline
Classification Chemical
Copyright Copyright © 2024 DigiLab GmbH and Wiley-VCH GmbH. All Rights Reserved.
Exact Mass 356.978122123 u
Formula C14H13ClIN
InChI InChI=1S/C14H13ClIN/c1-17(14-7-5-12(15)6-8-14)10-11-3-2-4-13(16)9-11/h2-9H,10H2,1H3
InChIKey OXEMMSGGAIWWNQ-UHFFFAOYSA-N
Ionization Type Electron Ionization (EI)
Molecular Weight 357.622 g/mol
Nominal Mass 357 u
Quality 999
Retention Index 2429
SMILES C1(N(CC=2C=C(C=CC2)I)C)=CC=C(C=C1)Cl
SPLASH splash10-1003-5932000000-dcb408ba9afcb9e1a03e
Source of Spectrum DigiLab GmbH (C) 2024
Synonyms 4-chloro-N-(3-iodobenzyl)-N-methylaniline
Technique GC/MS
Wiley ID DD2024_025786