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1-Benzyl-N-(3-bromobenzyl)-N-(3-fluorophenyl)piperidin-4-amine
SpectraBase Compound ID EqVNr4nNdq9
InChI InChI=1S/C25H26BrFN2/c26-22-9-4-8-21(16-22)19-29(25-11-5-10-23(27)17-25)24-12-14-28(15-13-24)18-20-6-2-1-3-7-20/h1-11,16-17,24H,12-15,18-19H2
InChIKey XOGDXEXPKJEDJO-UHFFFAOYSA-N
Mol Weight 453.4 g/mol
Molecular Formula C25H26BrFN2
Exact Mass 452.12634 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID GUsW05AqJge
Name 1-Benzyl-N-(3-bromobenzyl)-N-(3-fluorophenyl)piperidin-4-amine
Classification Fentalogue
Copyright Copyright © 2024 DigiLab GmbH and Wiley-VCH GmbH. All Rights Reserved.
Exact Mass 452.126340008 u
Formula C25H26BrFN2
InChI InChI=1S/C25H26BrFN2/c26-22-9-4-8-21(16-22)19-29(25-11-5-10-23(27)17-25)24-12-14-28(15-13-24)18-20-6-2-1-3-7-20/h1-11,16-17,24H,12-15,18-19H2
InChIKey XOGDXEXPKJEDJO-UHFFFAOYSA-N
Ionization Type Electron Ionization (EI)
Molecular Weight 453.399 g/mol
Nominal Mass 452 u
Quality 991
Retention Index 3281
SMILES C1(N(C2CCN(CC=3C=CC=CC3)CC2)CC=2C=C(C=CC2)Br)=CC(=CC=C1)F
SPLASH splash10-00dl-4910000000-9d25d6c1d91624491696
Source of Spectrum DigiLab GmbH (C) 2024
Synonyms Fentanyl(-propionyl+3-bromobenzyl-phenyl+3-fluorophenyl-phenethyl+benzyl)
Technique GC/MS
Wiley ID DD2024_026019