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N-(3-Iodobenzyl)-3-bromobenzeneethanamine
SpectraBase Compound ID xzryz6EF6a
InChI InChI=1S/C15H15BrIN/c16-14-5-1-3-12(9-14)7-8-18-11-13-4-2-6-15(17)10-13/h1-6,9-10,18H,7-8,11H2
InChIKey RPVYVXRRYOVRIJ-UHFFFAOYSA-N
Mol Weight 416.1 g/mol
Molecular Formula C15H15BrIN
Exact Mass 414.943257 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID DkxKJ69c6V6
Name N-(3-Iodobenzyl)-3-bromobenzeneethanamine
Classification Chemical
Copyright Copyright © 2024 DigiLab GmbH and Wiley-VCH GmbH. All Rights Reserved.
Exact Mass 414.943257487 u
Formula C15H15BrIN
InChI InChI=1S/C15H15BrIN/c16-14-5-1-3-12(9-14)7-8-18-11-13-4-2-6-15(17)10-13/h1-6,9-10,18H,7-8,11H2
InChIKey RPVYVXRRYOVRIJ-UHFFFAOYSA-N
Ionization Type Electron Ionization (EI)
Molecular Weight 416.100 g/mol
Nominal Mass 415 u
Quality 982
Retention Index 2548
SMILES C=1(CNCCC=2C=C(C=CC2)Br)C=C(C=CC1)I
SPLASH splash10-0002-2190000000-7b230b0bd40a57d14da1
Source of Spectrum DigiLab GmbH (C) 2024
Synonyms N-(3-Iodobenzyl)-3-bromophenethylamine 2-(3-bromophenyl)-N-(3-iodobenzyl)ethan-1-amine
Technique GC/MS
Wiley ID DD2024_021770