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Hexanoylfentanyl
SpectraBase Compound ID 6ghTtfrIMWw
InChI InChI=1S/C25H34N2O/c1-2-3-6-15-25(28)27(23-13-9-5-10-14-23)24-17-20-26(21-18-24)19-16-22-11-7-4-8-12-22/h4-5,7-14,24H,2-3,6,15-21H2,1H3
InChIKey PWKBFVCAQVONRR-UHFFFAOYSA-N
Mol Weight 378.6 g/mol
Molecular Formula C25H34N2O
Exact Mass 378.267114 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 8FZbhE6pAy8
Name Hexanoylfentanyl
Classification Fentanyl opioid
Comments Spectrum verified by independent measurements in external laboratories
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 378.267113722 u
Formula C25H34N2O
InChI InChI=1S/C25H34N2O/c1-2-3-6-15-25(28)27(23-13-9-5-10-14-23)24-17-20-26(21-18-24)19-16-22-11-7-4-8-12-22/h4-5,7-14,24H,2-3,6,15-21H2,1H3
InChIKey PWKBFVCAQVONRR-UHFFFAOYSA-N
Ionization Type Electron Ionization (EI)
Molecular Weight 378.560 g/mol
Nominal Mass 378 u
Quality 990
Retention Index 3008
SMILES C1(N(C2=CC=CC=C2)C(CCCCC)=O)CCN(CC1)CCC=1C=CC=CC1
SPLASH splash10-000i-4890000000-5083fd27f4f08c953492
Source of Spectrum DigiLab GmbH (C) 2024
Synonyms Fentanyl(-phenethyl+hexanonyl) N-Phenyl-N-[1-(2-phenylethyl)piperidin-4-yl]hexanamide
Technique GC/MS
Wiley ID DD2024_024491