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N-4-Bromobenzyl-N-4-chlorophenyl-1-[2-(4-fluorophenyl)ethyl]piperidin-4-amine
SpectraBase Compound ID 7OKo2doAtbj
InChI InChI=1S/C26H27BrClFN2/c27-22-5-1-21(2-6-22)19-31(25-11-7-23(28)8-12-25)26-14-17-30(18-15-26)16-13-20-3-9-24(29)10-4-20/h1-12,26H,13-19H2
InChIKey RDMGQYFBCSTRCI-UHFFFAOYSA-N
Mol Weight 501.87 g/mol
Molecular Formula C26H27BrClFN2
Exact Mass 500.103018 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 5ZX9fBy8oQC
Name N-4-Bromobenzyl-N-4-chlorophenyl-1-[2-(4-fluorophenyl)ethyl]piperidin-4-amine
Classification Fentalogue
Copyright Copyright © 2024 DigiLab GmbH and Wiley-VCH GmbH. All Rights Reserved.
Exact Mass 500.103017740 u
Formula C26H27BrClFN2
InChI InChI=1S/C26H27BrClFN2/c27-22-5-1-21(2-6-22)19-31(25-11-7-23(28)8-12-25)26-14-17-30(18-15-26)16-13-20-3-9-24(29)10-4-20/h1-12,26H,13-19H2
InChIKey RDMGQYFBCSTRCI-UHFFFAOYSA-N
Ionization Type Electron Ionization (EI)
Molecular Weight 501.871 g/mol
Nominal Mass 500 u
Quality 997
Retention Index 3658
SMILES C1(N(C=2C=CC(=CC2)Cl)CC2=CC=C(C=C2)Br)CCN(CC1)CCC=1C=CC(=CC1)F
SPLASH splash10-00r2-6923000000-801b180e4b9720b3fecb
Source of Spectrum DigiLab GmbH (C) 2024
Synonyms Fentanyl(-propionyl+(4-bromobenzyl)-phenyl+(4-chlorophenyl)-phenethyl+[2-(4-fluorophenylethyl)])
Technique GC/MS
Wiley ID DD2024_031123