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N-(3-Fluorophenyl)-2-methyl-N-(1-[2-(thiophen-2-yl)ethyl]piperidin-4-yl)prop-2-enamide
SpectraBase Compound ID C8zknrrhlGQ
InChI InChI=1S/C21H25FN2OS/c1-16(2)21(25)24(19-6-3-5-17(22)15-19)18-8-11-23(12-9-18)13-10-20-7-4-14-26-20/h3-7,14-15,18H,1,8-13H2,2H3
InChIKey QDHWCSRCLWRRRS-UHFFFAOYSA-N
Mol Weight 372.5 g/mol
Molecular Formula C21H25FN2OS
Exact Mass 372.167163 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 8GZ3Nay6Zfs
Name N-(3-Fluorophenyl)-2-methyl-N-(1-[2-(thiophen-2-yl)ethyl]piperidin-4-yl)prop-2-enamide
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 372.167162769 u
Formula C21H25FN2OS
InChI InChI=1S/C21H25FN2OS/c1-16(2)21(25)24(19-6-3-5-17(22)15-19)18-8-11-23(12-9-18)13-10-20-7-4-14-26-20/h3-7,14-15,18H,1,8-13H2,2H3
InChIKey QDHWCSRCLWRRRS-UHFFFAOYSA-N
Ionization Type Electron Ionization (EI)
Molecular Weight 372.502 g/mol
Nominal Mass 372 u
Quality 980
Retention Index 2804
SMILES C1(N(C2=CC(=CC=C2)F)C(C(=C)C)=O)CCN(CC1)CCC=1SC=CC1
SPLASH splash10-004l-9070000000-a72eaa7dd05e78ae7196
Source of Spectrum DigiLab GmbH (C) 2024
Synonyms Fentanyl(-propionyl+2-methylprop-2-enoyl-phenyl+3-fluorophenyl-phenethyl+thiophen-2-yl-ethyl)
Technique GC/MS
Wiley ID DD2024_026449