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N-4-Chlorophenyl-1-[2-(4-fluorophenyl)ethyl]-N-3-iodobenzylpiperidin-4-amine
SpectraBase Compound ID 37CuVRMXO07
InChI InChI=1S/C26H27ClFIN2/c27-22-6-10-25(11-7-22)31(19-21-2-1-3-24(29)18-21)26-13-16-30(17-14-26)15-12-20-4-8-23(28)9-5-20/h1-11,18,26H,12-17,19H2
InChIKey HSQUYIMKPMULSI-UHFFFAOYSA-N
Mol Weight 548.87 g/mol
Molecular Formula C26H27ClFIN2
Exact Mass 548.08915 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID Dnrvh9VBjdY
Name N-4-Chlorophenyl-1-[2-(4-fluorophenyl)ethyl]-N-3-iodobenzylpiperidin-4-amine
Classification Fentalogue
Copyright Copyright © 2024 DigiLab GmbH and Wiley-VCH GmbH. All Rights Reserved.
Exact Mass 548.089149740 u
Formula C26H27ClFIN2
InChI InChI=1S/C26H27ClFIN2/c27-22-6-10-25(11-7-22)31(19-21-2-1-3-24(29)18-21)26-13-16-30(17-14-26)15-12-20-4-8-23(28)9-5-20/h1-11,18,26H,12-17,19H2
InChIKey HSQUYIMKPMULSI-UHFFFAOYSA-N
Ionization Type Electron Ionization (EI)
Molecular Weight 548.872 g/mol
Nominal Mass 548 u
Quality 983
Retention Index 3863
SMILES C1(N(C=2C=CC(=CC2)Cl)CC=2C=C(C=CC2)I)CCN(CC1)CCC=1C=CC(=CC1)F
SPLASH splash10-0002-9742200000-d706baadeb2bdf974447
Source of Spectrum DigiLab GmbH (C) 2024
Synonyms Fentanyl(-propionyl+(3-iodobenzyl)-phenyl+(4-chlorophenyl)-phenethyl+[2-(4-fluorophenylethyl)])
Technique GC/MS
Wiley ID DD2024_031118