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N-(3-Iodobenzyl)-N-(3-methylphenyl)-1-(2-phenylethyl)piperidin-4-amine
SpectraBase Compound ID BXwxp5cf1qA
InChI InChI=1S/C27H31IN2/c1-22-7-5-12-27(19-22)30(21-24-10-6-11-25(28)20-24)26-14-17-29(18-15-26)16-13-23-8-3-2-4-9-23/h2-12,19-20,26H,13-18,21H2,1H3
InChIKey YRLFETKMJINMGC-UHFFFAOYSA-N
Mol Weight 510.46 g/mol
Molecular Formula C27H31IN2
Exact Mass 510.153194 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID Dlt3Ur1vids
Name N-(3-Iodobenzyl)-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 510.153194006 u
Formula C27H31IN2
InChI InChI=1S/C27H31IN2/c1-22-7-5-12-27(19-22)30(21-24-10-6-11-25(28)20-24)26-14-17-29(18-15-26)16-13-23-8-3-2-4-9-23/h2-12,19-20,26H,13-18,21H2,1H3
InChIKey YRLFETKMJINMGC-UHFFFAOYSA-N
Ionization Type Electron Ionization (EI)
Molecular Weight 510.463 g/mol
Nominal Mass 510 u
Quality 999
Retention Index 3655
SMILES C1(N(C2=CC(=CC=C2)C)CC2=CC(=CC=C2)I)CCN(CC1)CCC=1C=CC=CC1
SPLASH splash10-0002-9721100000-dd8de5eefca3fb13cf00
Source of Spectrum DigiLab GmbH (C) 2024
Synonyms Fentanyl(-propionyl+(3-iodobenzyl)-phenyl+(3-methylphenyl))
Technique GC/MS
Wiley ID DD2024_025277