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beta-Methylphenethylamine N-(3-bromobenzyl)
SpectraBase Compound ID 9qWYaxLPExc
InChI InChI=1S/C16H18BrN/c1-13(15-7-3-2-4-8-15)11-18-12-14-6-5-9-16(17)10-14/h2-10,13,18H,11-12H2,1H3
InChIKey BPNGQTPIMLIHRT-UHFFFAOYSA-N
Mol Weight 304.23 g/mol
Molecular Formula C16H18BrN
Exact Mass 303.062263 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 1An2OUkoDya
Name beta-Methylphenethylamine N-(3-bromobenzyl)
Classification Chemical
Copyright Copyright © 2024 DigiLab GmbH and Wiley-VCH GmbH. All Rights Reserved.
Exact Mass 303.062262584 u
Formula C16H18BrN
InChI InChI=1S/C16H18BrN/c1-13(15-7-3-2-4-8-15)11-18-12-14-6-5-9-16(17)10-14/h2-10,13,18H,11-12H2,1H3
InChIKey BPNGQTPIMLIHRT-UHFFFAOYSA-N
Ionization Type Electron Ionization (EI)
Molecular Weight 304.231 g/mol
Nominal Mass 303 u
Quality 986
Retention Index 2113
SMILES C1(CNCC(C=2C=CC=CC2)C)=CC(=CC=C1)Br
SPLASH splash10-0fxt-3930000000-28f2babaacb051e87044
Source of Spectrum DigiLab GmbH (C) 2024
Synonyms N-(3-Bromobenzyl)-2-phenylpropan-1-amine
Technique GC/MS
Wiley ID DD2024_022506