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

*Links on SpectraBase are not permalinks.
N-(3-Iodophenyl)-N-[1-(2-phenylethyl)piperidin-4-yl]thiophene-3-carboxamide
SpectraBase Compound ID G8gSkE2pYsS
InChI InChI=1S/C24H25IN2OS/c25-21-7-4-8-23(17-21)27(24(28)20-12-16-29-18-20)22-10-14-26(15-11-22)13-9-19-5-2-1-3-6-19/h1-8,12,16-18,22H,9-11,13-15H2
InChIKey KHENUJNCVJAMAU-UHFFFAOYSA-N
Mol Weight 516.44 g/mol
Molecular Formula C24H25IN2OS
Exact Mass 516.07323 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 8JlycNVtkA4
Name N-(3-Iodophenyl)-N-[1-(2-phenylethyl)piperidin-4-yl]thiophene-3-carboxamide
Classification Fentanyl opioid
Copyright Copyright © 2024 DigiLab GmbH and Wiley-VCH GmbH. All Rights Reserved.
Exact Mass 516.073229606 u
Formula C24H25IN2OS
InChI InChI=1S/C24H25IN2OS/c25-21-7-4-8-23(17-21)27(24(28)20-12-16-29-18-20)22-10-14-26(15-11-22)13-9-19-5-2-1-3-6-19/h1-8,12,16-18,22H,9-11,13-15H2
InChIKey KHENUJNCVJAMAU-UHFFFAOYSA-N
Ionization Type Electron Ionization (EI)
Molecular Weight 516.441 g/mol
Nominal Mass 516 u
Quality 1000
Retention Index 3645
SMILES C1(N(C(C=2C=CSC2)=O)C=2C=C(C=CC2)I)CCN(CC1)CCC=1C=CC=CC1
SPLASH splash10-03di-6910000000-4b7756f0f91eb940801e
Source of Spectrum DigiLab GmbH (C) 2024
Synonyms Fentanyl(-propionyl+(thiophene-3-carbonyl)-phenyl+(3-iodophenyl))
Technique GC/MS
Wiley ID DD2024_033949