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

*Links on SpectraBase are not permalinks.
N-3-Chlorophenyl-N-[1-(2-phenylethyl)piperidin-4-yl]hexanamide
SpectraBase Compound ID GmkUQUI76MC
InChI InChI=1S/C25H33ClN2O/c1-2-3-5-13-25(29)28(24-12-8-11-22(26)20-24)23-15-18-27(19-16-23)17-14-21-9-6-4-7-10-21/h4,6-12,20,23H,2-3,5,13-19H2,1H3
InChIKey PWQWCAVJFOZPFS-UHFFFAOYSA-N
Mol Weight 413.0 g/mol
Molecular Formula C25H33ClN2O
Exact Mass 412.228141 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 GUvIy9EHh4a
Name N-3-Chlorophenyl-N-[1-(2-phenylethyl)piperidin-4-yl]hexanamide
Classification Fentanyl opioid
Copyright Copyright © 2024 DigiLab GmbH and Wiley-VCH GmbH. All Rights Reserved.
DEA Citation 21 CFR §1308.11 (h) (30)
DEA Controlled Substance Name (i) Fentanyl-related substance means any substance not otherwise listed under another Administration Controlled Substance Code Number, and for which no exemption or approval is in effect under section 505 of the Federal Food, Drug, and Cosmetic Act [21 U.S.C. 355], that is structurally related to fentanyl by one or more of the following modifications:
DEA Controlled Substance Type Isomers, esters, ethers, salts and salts of isomers, esters and ethers
DEA Controlled Substances Code Number 9850
DEA Schedule Schedule I
DEA Section Temporary listing of substances subject to emergency scheduling. Any material, compound, mixture or preparation which contains any quantity of the following substances.
Exact Mass 412.228141390 u
Formula C25H33ClN2O
InChI InChI=1S/C25H33ClN2O/c1-2-3-5-13-25(29)28(24-12-8-11-22(26)20-24)23-15-18-27(19-16-23)17-14-21-9-6-4-7-10-21/h4,6-12,20,23H,2-3,5,13-19H2,1H3
InChIKey PWQWCAVJFOZPFS-UHFFFAOYSA-N
Ionization Type Electron Ionization (EI)
Molecular Weight 413.005 g/mol
Nominal Mass 412 u
Quality 994
Retention Index 3147
SMILES C1(N(C=2C=C(C=CC2)Cl)C(CCCCC)=O)CCN(CC1)CCC=1C=CC=CC1
SPLASH splash10-00di-4869000000-fe1fdf72cc0d92d37e5f
Source of Spectrum DigiLab GmbH (C) 2024
Synonyms Fentanyl(-propionyl+hexanoyl-phenyl+(3-chlorophenyl))
Technique GC/MS
Wiley ID DD2024_033284