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N-3-Methylphenyl-N-[1-(1-phenylpropan-2-yl)piperidin-4-yl]heptafluorobutanamide
SpectraBase Compound ID HlT34PXRLS1
InChI InChI=1S/C25H27F7N2O/c1-17-7-6-10-21(15-17)34(22(35)23(26,27)24(28,29)25(30,31)32)20-11-13-33(14-12-20)18(2)16-19-8-4-3-5-9-19/h3-10,15,18,20H,11-14,16H2,1-2H3
InChIKey RVSHCXGEJANYIM-UHFFFAOYSA-N
Mol Weight 504.49 g/mol
Molecular Formula C25H27F7N2O
Exact Mass 504.201161 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID JEdk7tWEtFI
Name N-3-Methylphenyl-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 504.201160637 u
Formula C25H27F7N2O
InChI InChI=1S/C25H27F7N2O/c1-17-7-6-10-21(15-17)34(22(35)23(26,27)24(28,29)25(30,31)32)20-11-13-33(14-12-20)18(2)16-19-8-4-3-5-9-19/h3-10,15,18,20H,11-14,16H2,1-2H3
InChIKey RVSHCXGEJANYIM-UHFFFAOYSA-N
Ionization Type Electron Ionization (EI)
Molecular Weight 504.493 g/mol
Nominal Mass 504 u
Quality 998
Retention Index 2532
SMILES C(C(C(F)(F)F)(F)F)(C(N(C=1C=C(C=CC1)C)C1CCN(C(CC=2C=CC=CC2)C)CC1)=O)(F)F
SPLASH splash10-03di-1101900000-cba7e13305616fd3d54e
Source of Spectrum DigiLab GmbH (C) 2024
Synonyms Fentanyl(-propionyl+heptafluorobutyryl-phenyl+3-methylphenyl-phenethyl+1-phenylpropan-2-yl)
Technique GC/MS
Wiley ID DD2024_027245