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N-4-Methylphenyl-N-[1-(1-phenylpropan-2-yl)piperidin-4-yl]hexanamide
SpectraBase Compound ID 532dEUnTdA8
InChI InChI=1S/C27H38N2O/c1-4-5-7-12-27(30)29(25-15-13-22(2)14-16-25)26-17-19-28(20-18-26)23(3)21-24-10-8-6-9-11-24/h6,8-11,13-16,23,26H,4-5,7,12,17-21H2,1-3H3
InChIKey NLBQAPARMZVEGT-UHFFFAOYSA-N
Mol Weight 406.6 g/mol
Molecular Formula C27H38N2O
Exact Mass 406.298414 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID JJez4cpt476
Name N-4-Methylphenyl-N-[1-(1-phenylpropan-2-yl)piperidin-4-yl]hexanamide
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 406.298413851 u
Formula C27H38N2O
InChI InChI=1S/C27H38N2O/c1-4-5-7-12-27(30)29(25-15-13-22(2)14-16-25)26-17-19-28(20-18-26)23(3)21-24-10-8-6-9-11-24/h6,8-11,13-16,23,26H,4-5,7,12,17-21H2,1-3H3
InChIKey NLBQAPARMZVEGT-UHFFFAOYSA-N
Ionization Type Electron Ionization (EI)
Molecular Weight 406.614 g/mol
Nominal Mass 406 u
Quality 997
Retention Index 2879
SMILES C1(N(C=2C=CC(=CC2)C)C(CCCCC)=O)CCN(C(CC=2C=CC=CC2)C)CC1
SPLASH splash10-014i-4529000000-7b504e0670b976fd0f9d
Source of Spectrum DigiLab GmbH (C) 2024
Synonyms Fentanyl(-propionyl+hexanoyl-phenyl+4-methylphenyl-phenethyl+1-phenylpropan-2-yl)
Technique GC/MS
Wiley ID DD2024_027179