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N-3-Chlorophenyl-2,2,3,3,4,4,4-heptafluoro-N-[1-(2-phenylethyl)piperidin-4-yl]butanamide
SpectraBase Compound ID CeJqZ5AVtdE
InChI InChI=1S/C23H22ClF7N2O/c24-17-7-4-8-19(15-17)33(20(34)21(25,26)22(27,28)23(29,30)31)18-10-13-32(14-11-18)12-9-16-5-2-1-3-6-16/h1-8,15,18H,9-14H2
InChIKey REWAOZZABWIQQA-UHFFFAOYSA-N
Mol Weight 510.88 g/mol
Molecular Formula C23H22ClF7N2O
Exact Mass 510.130888 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID DoDjbCztNcO
Name N-3-Chlorophenyl-2,2,3,3,4,4,4-heptafluoro-N-[1-(2-phenylethyl)piperidin-4-yl]butanamide
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 510.130888176 u
Formula C23H22ClF7N2O
InChI InChI=1S/C23H22ClF7N2O/c24-17-7-4-8-19(15-17)33(20(34)21(25,26)22(27,28)23(29,30)31)18-10-13-32(14-11-18)12-9-16-5-2-1-3-6-16/h1-8,15,18H,9-14H2
InChIKey REWAOZZABWIQQA-UHFFFAOYSA-N
Ionization Type Electron Ionization (EI)
Molecular Weight 510.884 g/mol
Nominal Mass 510 u
Quality 1000
Retention Index 2559
SMILES C(C(C(N(C1CCN(CC1)CCC=1C=CC=CC1)C=1C=C(C=CC1)Cl)=O)(F)F)(C(F)(F)F)(F)F
SPLASH splash10-014i-4403900000-db221869a7f89f5b8ee5
Source of Spectrum DigiLab GmbH (C) 2024
Synonyms Fentanyl(-propionyl+(2,2,3,3,4,4,4-heptafluorobutyryl)-phenyl+(3-chlorophenyl))
Technique GC/MS
Wiley ID DD2024_033287