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1-Benzyl-N-(3-fluorophenyl)-N-(2,2,3,3,3-pentafluoropropyl)piperidin-4-amine
SpectraBase Compound ID LBHGXWCQeNI
InChI InChI=1S/C21H22F6N2/c22-17-7-4-8-19(13-17)29(15-20(23,24)21(25,26)27)18-9-11-28(12-10-18)14-16-5-2-1-3-6-16/h1-8,13,18H,9-12,14-15H2
InChIKey WTPKJFHNIASBBV-UHFFFAOYSA-N
Mol Weight 416.41 g/mol
Molecular Formula C21H22F6N2
Exact Mass 416.168718 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 3jjntz125Q
Name 1-Benzyl-N-(3-fluorophenyl)-N-(2,2,3,3,3-pentafluoropropyl)piperidin-4-amine
Classification Fentanyl opioid
Copyright Copyright © 2024 DigiLab GmbH and Wiley-VCH GmbH. All Rights Reserved.
Exact Mass 416.168717694 u
Formula C21H22F6N2
InChI InChI=1S/C21H22F6N2/c22-17-7-4-8-19(13-17)29(15-20(23,24)21(25,26)27)18-9-11-28(12-10-18)14-16-5-2-1-3-6-16/h1-8,13,18H,9-12,14-15H2
InChIKey WTPKJFHNIASBBV-UHFFFAOYSA-N
Ionization Type Electron Ionization (EI)
Molecular Weight 416.411 g/mol
Nominal Mass 416 u
Quality 999
Retention Index 2241
SMILES C1(N(C2CCN(CC3=CC=CC=C3)CC2)CC(C(F)(F)F)(F)F)=CC(=CC=C1)F
SPLASH splash10-00dl-6920000000-796cab503b2b11f470ce
Source of Spectrum DigiLab GmbH (C) 2024
Synonyms Fentanyl(-propionyl+2233,3-pentafluoropropyl-phenyl+3-fluorophenyl-phenethyl+benzyl)
Technique GC/MS
Wiley ID DD2024_026032