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N-(3-Fluorophenyl)-N-(1-[2-(4-fluorophenyl)ethyl]piperidin-4-yl)-pent-4-enamide
SpectraBase Compound ID HAxAC827fqw
InChI InChI=1S/C24H28F2N2O/c1-2-3-7-24(29)28(23-6-4-5-21(26)18-23)22-13-16-27(17-14-22)15-12-19-8-10-20(25)11-9-19/h2,4-6,8-11,18,22H,1,3,7,12-17H2
InChIKey XFOUWJKVVXZVRQ-UHFFFAOYSA-N
Mol Weight 398.5 g/mol
Molecular Formula C24H28F2N2O
Exact Mass 398.21697 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 2kv884FHOe8
Name N-(3-Fluorophenyl)-N-(1-[2-(4-fluorophenyl)ethyl]piperidin-4-yl)-pent-4-enamide
Classification Fentalogue
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 398.216969855 u
Formula C24H28F2N2O
InChI InChI=1S/C24H28F2N2O/c1-2-3-7-24(29)28(23-6-4-5-21(26)18-23)22-13-16-27(17-14-22)15-12-19-8-10-20(25)11-9-19/h2,4-6,8-11,18,22H,1,3,7,12-17H2
InChIKey XFOUWJKVVXZVRQ-UHFFFAOYSA-N
Ionization Type Electron Ionization (EI)
Molecular Weight 398.498 g/mol
Nominal Mass 398 u
Quality 998
Retention Index 2785
SMILES C1(N(C=2C=C(C=CC2)F)C(CCC=C)=O)CCN(CC1)CCC=1C=CC(=CC1)F
SPLASH splash10-06ri-4690000000-bc01437ca3538bd5d93f
Source of Spectrum DigiLab GmbH (C) 2024
Synonyms Fentanyl(-propionyl+(pent-4-enoyl)-phenyl+(3-fluorophenyl)-phenethyl+[2-(4-fluorophenylethyl)])
Technique GC/MS
Wiley ID DD2024_029513