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N-(3-Trifluoromethylbenzyl)-N-phenyl-1-(1-phenylpropan-1-yl)piperidin-4-amine
SpectraBase Compound ID J23diozstA7
InChI InChI=1S/C28H31F3N2/c1-2-27(23-11-5-3-6-12-23)32-18-16-26(17-19-32)33(25-14-7-4-8-15-25)21-22-10-9-13-24(20-22)28(29,30)31/h3-15,20,26-27H,2,16-19,21H2,1H3
InChIKey XCRYSZQXUOVQBN-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 DoNGY9VSWXI
Name N-(3-Trifluoromethylbenzyl)-N-phenyl-1-(1-phenylpropan-1-yl)piperidin-4-amine
Classification Fentalogue
Copyright Copyright © 2024 DigiLab GmbH and Wiley-VCH GmbH. All Rights Reserved.
Exact Mass 452.243933495 u
Formula C28H31F3N2
InChI InChI=1S/C28H31F3N2/c1-2-27(23-11-5-3-6-12-23)32-18-16-26(17-19-32)33(25-14-7-4-8-15-25)21-22-10-9-13-24(20-22)28(29,30)31/h3-15,20,26-27H,2,16-19,21H2,1H3
InChIKey XCRYSZQXUOVQBN-UHFFFAOYSA-N
Ionization Type Electron Ionization (EI)
Molecular Weight 452.565 g/mol
Nominal Mass 452 u
Quality 980
Retention Index 2981
SMILES C1(N(C=2C=CC=CC2)CC2=CC(C(F)(F)F)=CC=C2)CCN(C(C=2C=CC=CC2)CC)CC1
SPLASH splash10-00dl-4941000000-db942059bcf14cbca8cc
Source of Spectrum DigiLab GmbH (C) 2024
Synonyms Fentanyl(-propionyl+3-trifluoromethylbenzyl-phenethyl+1-phenylpropan-1-yl) N-m-Trifluoromethylbenzyl-N-phenyl-1-(1-phenylpropan-1-yl)piperidin-4-amine
Technique GC/MS
Wiley ID DD2024_026788