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ANPP 3-fluoro PFP
SpectraBase Compound ID BeOkNLUxF5s
InChI InChI=1S/C22H22F6N2O/c23-17-7-4-8-19(15-17)30(20(31)21(24,25)22(26,27)28)18-10-13-29(14-11-18)12-9-16-5-2-1-3-6-16/h1-8,15,18H,9-14H2
InChIKey OBDQXGRRTTYKHG-UHFFFAOYSA-N
Mol Weight 444.42 g/mol
Molecular Formula C22H22F6N2O
Exact Mass 444.163632 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 8JtPWq7us1w
Name ANPP 3-fluoro PFP
Classification Chemical
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 444.163632313 u
Formula C22H22F6N2O
InChI InChI=1S/C22H22F6N2O/c23-17-7-4-8-19(15-17)30(20(31)21(24,25)22(26,27)28)18-10-13-29(14-11-18)12-9-16-5-2-1-3-6-16/h1-8,15,18H,9-14H2
InChIKey OBDQXGRRTTYKHG-UHFFFAOYSA-N
Ionization Type Electron Ionization (EI)
Molecular Weight 444.421 g/mol
Nominal Mass 444 u
Quality 1000
Retention Index 2383
SMILES C(N(C1=CC(=CC=C1)F)C1CCN(CC1)CCC=1C=CC=CC1)(C(C(F)(F)F)(F)F)=O
SPLASH splash10-0udi-4419000000-d3104c92aa51c552457a
Source of Spectrum DigiLab GmbH (C) 2024
Synonyms Fentanyl(-propionyl+pentafluoropropionyl-phenyl+(3-fluorophenyl)) 2,2,3,3,3-Pentafluoro-N-(3-fluorophenyl)-N-(1-(2-phenylethyl)piperidin-4-yl)propanamide
Technique GC/MS
Wiley ID DD2024_024816