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1-[2-(4-Fluorophenyl)ethyl]-N-3-iodobenzyl-N-3-methylphenylpiperidin-4-amine
SpectraBase Compound ID xVxc6i8H7O
InChI InChI=1S/C27H30FIN2/c1-21-4-2-7-27(18-21)31(20-23-5-3-6-25(29)19-23)26-13-16-30(17-14-26)15-12-22-8-10-24(28)11-9-22/h2-11,18-19,26H,12-17,20H2,1H3
InChIKey PUOCVNHOVQVZTI-UHFFFAOYSA-N
Mol Weight 528.45 g/mol
Molecular Formula C27H30FIN2
Exact Mass 528.143772 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID B0N7uPCGea8
Name 1-[2-(4-Fluorophenyl)ethyl]-N-3-iodobenzyl-N-3-methylphenylpiperidin-4-amine
Classification Fentanyl opioid
Copyright Copyright © 2024 DigiLab GmbH and Wiley-VCH GmbH. All Rights Reserved.
Exact Mass 528.143772137 u
Formula C27H30FIN2
InChI InChI=1S/C27H30FIN2/c1-21-4-2-7-27(18-21)31(20-23-5-3-6-25(29)19-23)26-13-16-30(17-14-26)15-12-22-8-10-24(28)11-9-22/h2-11,18-19,26H,12-17,20H2,1H3
InChIKey PUOCVNHOVQVZTI-UHFFFAOYSA-N
Ionization Type Electron Ionization (EI)
Molecular Weight 528.454 g/mol
Nominal Mass 528 u
Quality 996
Retention Index 3503
SMILES C1(N(C=2C=C(C=CC2)C)CC=2C=C(C=CC2)I)CCN(CC1)CCC=1C=CC(=CC1)F
SPLASH splash10-00kb-9522200000-c3646b5058206b31f9c0
Source of Spectrum DigiLab GmbH (C) 2024
Synonyms Fentanyl(-propionyl+(3-iodobenzyl)-phenyl+(3-methylphenyl)-phenethyl+[2-(4-fluorophenylethyl)])
Technique GC/MS
Wiley ID DD2024_030322