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4-Fluoropentanoylfentanyl
SpectraBase Compound ID SgdHLjsV5W
InChI InChI=1S/C24H31FN2O/c1-2-3-9-24(28)27(22-12-10-21(25)11-13-22)23-15-18-26(19-16-23)17-14-20-7-5-4-6-8-20/h4-8,10-13,23H,2-3,9,14-19H2,1H3
InChIKey LRGKRSJHHVAEAD-UHFFFAOYSA-N
Mol Weight 382.52 g/mol
Molecular Formula C24H31FN2O
Exact Mass 382.242042 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID HnKyT5ypkOO
Name 4-Fluoropentanoylfentanyl
Classification Fentanyl opioid
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 382.242041788 u
Formula C24H31FN2O
InChI InChI=1S/C24H31FN2O/c1-2-3-9-24(28)27(22-12-10-21(25)11-13-22)23-15-18-26(19-16-23)17-14-20-7-5-4-6-8-20/h4-8,10-13,23H,2-3,9,14-19H2,1H3
InChIKey LRGKRSJHHVAEAD-UHFFFAOYSA-N
Ionization Type Electron Ionization (EI)
Molecular Weight 382.523 g/mol
Nominal Mass 382 u
Quality 776
Retention Index 2916
SMILES C1(N(C2=CC=C(C=C2)F)C(CCCC)=O)CCN(CC1)CCC=1C=CC=CC1
SPLASH splash10-052f-6790000000-79622faa6cd705193ed2
Source of Spectrum DigiLab GmbH (C) 2024
Synonyms Fentanyl(-propionyl+pentanoyl-phenyl+(4-fluorophenyl)) N-(4-Fluorophenyl)-N-[1-(2-phenylethyl)piperidin-4-yl]pentanamide
Technique GC/MS
Wiley ID DD2024_008722