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N-(3-Trifluoromethylbenzyl)-N-(3-methylphenyl)-1-(2-phenylethyl)piperidin-4-amine
SpectraBase Compound ID 6f6cgsBgK76
InChI InChI=1S/C28H31F3N2/c1-22-7-5-12-27(19-22)33(21-24-10-6-11-25(20-24)28(29,30)31)26-14-17-32(18-15-26)16-13-23-8-3-2-4-9-23/h2-12,19-20,26H,13-18,21H2,1H3
InChIKey SKGYPCZEQMSODL-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 5JbzsDSmoq
Name N-(3-Trifluoromethylbenzyl)-N-(3-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/c1-22-7-5-12-27(19-22)33(21-24-10-6-11-25(20-24)28(29,30)31)26-14-17-32(18-15-26)16-13-23-8-3-2-4-9-23/h2-12,19-20,26H,13-18,21H2,1H3
InChIKey SKGYPCZEQMSODL-UHFFFAOYSA-N
Ionization Type Electron Ionization (EI)
Molecular Weight 452.565 g/mol
Nominal Mass 452 u
Quality 999
Retention Index 3006
SMILES C1(N(C=2C=C(C=CC2)C)CC2=CC(C(F)(F)F)=CC=C2)CCN(CC1)CCC=1C=CC=CC1
SPLASH splash10-06r2-9815000000-89cdd5e97d7024de6d8e
Source of Spectrum DigiLab GmbH (C) 2024
Synonyms Fentanyl(-propionyl+(3-trifluoromethylbenzyl)-phenyl+(3-methylphenyl)) N-(3-Methylphenyl)-1-(2-phenylethyl)-N-(3-(trifluoromethyl)benzyl)piperidin-4-amine
Technique GC/MS
Wiley ID DD2024_025272