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N-3-Methylphenyl-N-(1-[2-(thiophen-2-yl)ethyl]piperidin-4-yl)cyclohexanecarboxamide
SpectraBase Compound ID KTzLRXRfHaH
InChI InChI=1S/C25H34N2OS/c1-20-7-5-10-23(19-20)27(25(28)21-8-3-2-4-9-21)22-12-15-26(16-13-22)17-14-24-11-6-18-29-24/h5-7,10-11,18-19,21-22H,2-4,8-9,12-17H2,1H3
InChIKey TWXDWPDMWQLVHH-UHFFFAOYSA-N
Mol Weight 410.6 g/mol
Molecular Formula C25H34N2OS
Exact Mass 410.239185 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID B4FPOPlhYdE
Name N-3-Methylphenyl-N-(1-[2-(thiophen-2-yl)ethyl]piperidin-4-yl)cyclohexanecarboxamide
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 410.239184896 u
Formula C25H34N2OS
InChI InChI=1S/C25H34N2OS/c1-20-7-5-10-23(19-20)27(25(28)21-8-3-2-4-9-21)22-12-15-26(16-13-22)17-14-24-11-6-18-29-24/h5-7,10-11,18-19,21-22H,2-4,8-9,12-17H2,1H3
InChIKey TWXDWPDMWQLVHH-UHFFFAOYSA-N
Ionization Type Electron Ionization (EI)
Molecular Weight 410.620 g/mol
Nominal Mass 410 u
Quality 1000
Retention Index 3207
SMILES C1(N(C(C2CCCCC2)=O)C=2C=C(C=CC2)C)CCN(CC1)CCC=1SC=CC1
SPLASH splash10-0ik9-9832000000-7d7772e92688ae4fe34b
Source of Spectrum DigiLab GmbH (C) 2024
Synonyms Fentanyl(-propionyl+cyclohexylcarbonyl-phenyl+(3-methylphenyl)-phenethyl+[2-(thiophen-2-yl)ethyl])
Technique GC/MS
Wiley ID DD2024_031300