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2,2,3,3,4,4,4-Heptafluoro-N-(1-[2-(4-fluorophenyl)ethyl]piperidin-4-yl)-N-2-methylphenylbutanamide
SpectraBase Compound ID LxW4MSdxioC
InChI InChI=1S/C24H24F8N2O/c1-16-4-2-3-5-20(16)34(21(35)22(26,27)23(28,29)24(30,31)32)19-11-14-33(15-12-19)13-10-17-6-8-18(25)9-7-17/h2-9,19H,10-15H2,1H3
InChIKey JZJUWCVWSRHENK-UHFFFAOYSA-N
Mol Weight 508.46 g/mol
Molecular Formula C24H24F8N2O
Exact Mass 508.176089 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID JIVdZIbjeMa
Name 2,2,3,3,4,4,4-Heptafluoro-N-(1-[2-(4-fluorophenyl)ethyl]piperidin-4-yl)-N-2-methylphenylbutanamide
Classification Fentalogue
Comments Spectrum verified by independent measurements in external laboratories
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 508.176088704 u
Formula C24H24F8N2O
InChI InChI=1S/C24H24F8N2O/c1-16-4-2-3-5-20(16)34(21(35)22(26,27)23(28,29)24(30,31)32)19-11-14-33(15-12-19)13-10-17-6-8-18(25)9-7-17/h2-9,19H,10-15H2,1H3
InChIKey JZJUWCVWSRHENK-UHFFFAOYSA-N
Ionization Type Electron Ionization (EI)
Molecular Weight 508.456 g/mol
Nominal Mass 508 u
Quality 1000
Retention Index 2437
SMILES C(C(C(F)(F)F)(F)F)(C(N(C=1C(=CC=CC1)C)C1CCN(CC1)CCC=1C=CC(=CC1)F)=O)(F)F
SPLASH splash10-052b-7819100000-cd6a281371ce5fd6228f
Source of Spectrum DigiLab GmbH (C) 2024
Synonyms Fentanyl(-propionyl+heptafluorobutyryl-phenyl+(2-methylphenyl)-phenethyl+[2-(4-fluorophenylethyl)])
Technique GC/MS
Wiley ID DD2024_030673