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N-(3-Trifluoromethylbenzyl)-N-(2-methylphenyl)-1-(2-phenylethyl)piperidin-4-amine
SpectraBase Compound ID C43ASMmaDxc
InChI InChI=1S/C28H31F3N2/c1-22-8-5-6-13-27(22)33(21-24-11-7-12-25(20-24)28(29,30)31)26-15-18-32(19-16-26)17-14-23-9-3-2-4-10-23/h2-13,20,26H,14-19,21H2,1H3
InChIKey BCUIAJNDMBUKTN-UHFFFAOYSA-N
Mol Weight 452.57 g/mol
Molecular Formula C28H31F3N2
Exact Mass 452.243933 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 4GGy4Dsw64
Name N-(3-Trifluoromethylbenzyl)-N-(2-methylphenyl)-1-(2-phenylethyl)piperidin-4-amine
Classification Fentanyl opioid
Copyright Copyright © 2024 DigiLab GmbH and Wiley-VCH GmbH. All Rights Reserved.
Exact Mass 452.243933495 u
Formula C28H31F3N2
InChI InChI=1S/C28H31F3N2/c1-22-8-5-6-13-27(22)33(21-24-11-7-12-25(20-24)28(29,30)31)26-15-18-32(19-16-26)17-14-23-9-3-2-4-10-23/h2-13,20,26H,14-19,21H2,1H3
InChIKey BCUIAJNDMBUKTN-UHFFFAOYSA-N
Ionization Type Electron Ionization (EI)
Molecular Weight 452.565 g/mol
Nominal Mass 452 u
Quality 995
Retention Index 2961
SMILES C=1(N(C2CCN(CC2)CCC=2C=CC=CC2)CC2=CC(C(F)(F)F)=CC=C2)C(=CC=CC1)C
SPLASH splash10-07bb-7924000000-23b94a0e7efa35db5c95
Source of Spectrum DigiLab GmbH (C) 2024
Synonyms Fentanyl(-propionyl+(3-trifluoromethylbenzyl)-phenyl+(2-methylphenyl))
Technique GC/MS
Wiley ID DD2024_025524