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N-4-Methoxyphenyl-N-[1-(1-phenylpropan-2-yl)piperidin-4-yl]heptafluorobutanamide
SpectraBase Compound ID J00Z5fMs56B
InChI InChI=1S/C25H27F7N2O2/c1-17(16-18-6-4-3-5-7-18)33-14-12-20(13-15-33)34(19-8-10-21(36-2)11-9-19)22(35)23(26,27)24(28,29)25(30,31)32/h3-11,17,20H,12-16H2,1-2H3
InChIKey GHHYBHHEDPTUMX-UHFFFAOYSA-N
Mol Weight 520.49 g/mol
Molecular Formula C25H27F7N2O2
Exact Mass 520.196075 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID JGBB2zrv8KW
Name N-4-Methoxyphenyl-N-[1-(1-phenylpropan-2-yl)piperidin-4-yl]heptafluorobutanamide
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 520.196075256 u
Formula C25H27F7N2O2
InChI InChI=1S/C25H27F7N2O2/c1-17(16-18-6-4-3-5-7-18)33-14-12-20(13-15-33)34(19-8-10-21(36-2)11-9-19)22(35)23(26,27)24(28,29)25(30,31)32/h3-11,17,20H,12-16H2,1-2H3
InChIKey GHHYBHHEDPTUMX-UHFFFAOYSA-N
Ionization Type Electron Ionization (EI)
Molecular Weight 520.492 g/mol
Nominal Mass 520 u
Quality 1000
Retention Index 2724
SMILES C(C(C(F)(F)F)(F)F)(C(N(C1CCN(C(CC=2C=CC=CC2)C)CC1)C=1C=CC(=CC1)OC)=O)(F)F
SPLASH splash10-004l-9611400000-ec80940509951eaacbcc
Source of Spectrum DigiLab GmbH (C) 2024
Synonyms Fentanyl(-propionyl+heptafluorobutyryl-phenyl+4-methoxyphenyl-phenethyl+1-phenylpropan-2-yl)
Technique GC/MS
Wiley ID DD2024_027516