For citations & permissions, please see: Citations & Permissions - Wiley Science Solutions*

*Links on SpectraBase are not permalinks.
1-Benzyl-N-(3-iodobenzyl)-N-(4-methylphenyl)-piperidin-4-amine
SpectraBase Compound ID BRanLB5urvN
InChI InChI=1S/C26H29IN2/c1-21-10-12-25(13-11-21)29(20-23-8-5-9-24(27)18-23)26-14-16-28(17-15-26)19-22-6-3-2-4-7-22/h2-13,18,26H,14-17,19-20H2,1H3
InChIKey MMAGZNAXUNNHNR-UHFFFAOYSA-N
Mol Weight 496.44 g/mol
Molecular Formula C26H29IN2
Exact Mass 496.137544 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

View the Full Spectrum for FREE!

The full spectrum can only be viewed using a FREE account.

SpectraBase Spectrum ID 5XOG9QpQI1Q
Name 1-Benzyl-N-(3-iodobenzyl)-N-(4-methylphenyl)-piperidin-4-amine
Classification Fentanyl opioid
Copyright Copyright © 2024 DigiLab GmbH and Wiley-VCH GmbH. All Rights Reserved.
Exact Mass 496.137543942 u
Formula C26H29IN2
InChI InChI=1S/C26H29IN2/c1-21-10-12-25(13-11-21)29(20-23-8-5-9-24(27)18-23)26-14-16-28(17-15-26)19-22-6-3-2-4-7-22/h2-13,18,26H,14-17,19-20H2,1H3
InChIKey MMAGZNAXUNNHNR-UHFFFAOYSA-N
Ionization Type Electron Ionization (EI)
Molecular Weight 496.436 g/mol
Nominal Mass 496 u
Quality 948
Retention Index 3462
SMILES C1(N(C=2C=CC(=CC2)C)CC2=CC(=CC=C2)I)CCN(CC1)CC1=CC=CC=C1
SPLASH splash10-00di-4910000000-5be09839f87f9b4cb529
Source of Spectrum DigiLab GmbH (C) 2024
Synonyms Fentanyl(-phenyl+4-methylphenyl-propionyl+3-iodobenzyl-phenethyl+benzyl)
Technique GC/MS
Wiley ID DD2024_026047