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3-Phenylpropylamine N,N-bis(3-bromobenzyl)
SpectraBase Compound ID tqaOr48yT8
InChI InChI=1S/C23H23Br2N/c24-22-12-4-9-20(15-22)17-26(18-21-10-5-13-23(25)16-21)14-6-11-19-7-2-1-3-8-19/h1-5,7-10,12-13,15-16H,6,11,14,17-18H2
InChIKey GAYJQMMVNDMOAH-UHFFFAOYSA-N
Mol Weight 473.25 g/mol
Molecular Formula C23H23Br2N
Exact Mass 471.019726 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID DeZ7yXZpbaW
Name 3-Phenylpropylamine N,N-bis(3-bromobenzyl)
Classification Chemical
Copyright Copyright © 2024 DigiLab GmbH and Wiley-VCH GmbH. All Rights Reserved.
Exact Mass 471.019725745 u
Formula C23H23Br2N
InChI InChI=1S/C23H23Br2N/c24-22-12-4-9-20(15-22)17-26(18-21-10-5-13-23(25)16-21)14-6-11-19-7-2-1-3-8-19/h1-5,7-10,12-13,15-16H,6,11,14,17-18H2
InChIKey GAYJQMMVNDMOAH-UHFFFAOYSA-N
Ionization Type Electron Ionization (EI)
Molecular Weight 473.252 g/mol
Nominal Mass 471 u
Quality 990
Retention Index 3085
SMILES C(N(CC1=CC(=CC=C1)Br)CCCC1=CC=CC=C1)C=1C=C(C=CC1)Br
SPLASH splash10-014i-3509000000-9dda92d2c3bb4d3414ea
Source of Spectrum DigiLab GmbH (C) 2024
Synonyms N,N-Bis(3-bromobenzyl)-3-phenylpropan-1-amine
Technique GC/MS
Wiley ID DD2024_022509