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N-(3-Methylphenyl)-N,1-bis-([3-(trifluoromethyl)phenyl]methyl)piperidin-4-amine
SpectraBase Compound ID IK8hkrn2SE0
InChI InChI=1S/C28H28F6N2/c1-20-5-2-10-26(15-20)36(19-22-7-4-9-24(17-22)28(32,33)34)25-11-13-35(14-12-25)18-21-6-3-8-23(16-21)27(29,30)31/h2-10,15-17,25H,11-14,18-19H2,1H3
InChIKey RLYBPAOPBKVSJM-UHFFFAOYSA-N
Mol Weight 506.54 g/mol
Molecular Formula C28H28F6N2
Exact Mass 506.215668 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 5WJcsk8AWu0
Name N-(3-Methylphenyl)-N,1-bis-([3-(trifluoromethyl)phenyl]methyl)piperidin-4-amine
Classification Fentalogue
Copyright Copyright © 2024 DigiLab GmbH and Wiley-VCH GmbH. All Rights Reserved.
Exact Mass 506.215667888 u
Formula C28H28F6N2
InChI InChI=1S/C28H28F6N2/c1-20-5-2-10-26(15-20)36(19-22-7-4-9-24(17-22)28(32,33)34)25-11-13-35(14-12-25)18-21-6-3-8-23(16-21)27(29,30)31/h2-10,15-17,25H,11-14,18-19H2,1H3
InChIKey RLYBPAOPBKVSJM-UHFFFAOYSA-N
Ionization Type Electron Ionization (EI)
Molecular Weight 506.536 g/mol
Nominal Mass 506 u
Quality 998
Retention Index 2680
SMILES C1(N(C=2C=C(C=CC2)C)CC2=CC(C(F)(F)F)=CC=C2)CCN(CC=2C=C(C(F)(F)F)C=CC2)CC1
SPLASH splash10-0006-1590000000-8b09ed99bcac90b4aef1
Source of Spectrum DigiLab GmbH (C) 2024
Synonyms Fentanyl(-propionyl+3-(trifluoromethyl)benzyl-phenyl+(4-methylphenyl)-phenethyl+3-(trifluoromethyl)benzyl)
Technique GC/MS
Wiley ID DD2024_031194