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N-3-Bromobenzyl-N-phenyl-1-[2-(thiophen-2-yl)ethyl]piperidin-4-amine
SpectraBase Compound ID 5rYPjT5UomC
InChI InChI=1S/C24H27BrN2S/c25-21-7-4-6-20(18-21)19-27(22-8-2-1-3-9-22)23-11-14-26(15-12-23)16-13-24-10-5-17-28-24/h1-10,17-18,23H,11-16,19H2
InChIKey BIKVISHSPWUJIJ-UHFFFAOYSA-N
Mol Weight 455.46 g/mol
Molecular Formula C24H27BrN2S
Exact Mass 454.107833 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 1Ejqe4P23fU
Name N-3-Bromobenzyl-N-phenyl-1-[2-(thiophen-2-yl)ethyl]piperidin-4-amine
Classification Fentanyl opioid
Copyright Copyright © 2024 DigiLab GmbH and Wiley-VCH GmbH. All Rights Reserved.
Exact Mass 454.107833051 u
Formula C24H27BrN2S
InChI InChI=1S/C24H27BrN2S/c25-21-7-4-6-20(18-21)19-27(22-8-2-1-3-9-22)23-11-14-26(15-12-23)16-13-24-10-5-17-28-24/h1-10,17-18,23H,11-16,19H2
InChIKey BIKVISHSPWUJIJ-UHFFFAOYSA-N
Ionization Type Electron Ionization (EI)
Molecular Weight 455.458 g/mol
Nominal Mass 454 u
Quality 927
Retention Index 3455
SMILES C1(N(C=2C=CC=CC2)CC=2C=C(C=CC2)Br)CCN(CC1)CCC=1SC=CC1
SPLASH splash10-0a4i-9428000000-8b9e2bf0917cb646c675
Source of Spectrum DigiLab GmbH (C) 2024
Synonyms N-(3-Bromobenzyl)-N-phenyl-1-[2-(thiophen-2-yl)ethyl]piperidin-4-amine
Technique GC/MS
Wiley ID DD2024_026492