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N-2-Methylphenyl-N-[1-(2-phenylethyl)piperidin-4-yl]cyclohexanecarboxamide
SpectraBase Compound ID 8k4uaWncJQd
InChI InChI=1S/C27H36N2O/c1-22-10-8-9-15-26(22)29(27(30)24-13-6-3-7-14-24)25-17-20-28(21-18-25)19-16-23-11-4-2-5-12-23/h2,4-5,8-12,15,24-25H,3,6-7,13-14,16-21H2,1H3
InChIKey OSUCMXZTEKEVRK-UHFFFAOYSA-N
Mol Weight 404.6 g/mol
Molecular Formula C27H36N2O
Exact Mass 404.282764 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID JFJx3mH34FM
Name N-2-Methylphenyl-N-[1-(2-phenylethyl)piperidin-4-yl]cyclohexanecarboxamide
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 404.282763786 u
Formula C27H36N2O
InChI InChI=1S/C27H36N2O/c1-22-10-8-9-15-26(22)29(27(30)24-13-6-3-7-14-24)25-17-20-28(21-18-25)19-16-23-11-4-2-5-12-23/h2,4-5,8-12,15,24-25H,3,6-7,13-14,16-21H2,1H3
InChIKey OSUCMXZTEKEVRK-UHFFFAOYSA-N
Ionization Type Electron Ionization (EI)
Molecular Weight 404.598 g/mol
Nominal Mass 404 u
Quality 996
Retention Index 3206
SMILES C=1(N(C2CCN(CC2)CCC=2C=CC=CC2)C(C2CCCCC2)=O)C(=CC=CC1)C
SPLASH splash10-0ik9-5974000000-6819ae731b5af38b2d2c
Source of Spectrum DigiLab GmbH (C) 2024
Synonyms Fentanyl(-propionyl+cyclohexanecarbonyl-phenyl+(2-methylphenyl))
Technique GC/MS
Wiley ID DD2024_031184