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N-Allyl-N-(3-methylphenyl)-1-[2-(thiophen-2-yl)ethyl]piperidin-4-amine
SpectraBase Compound ID 7tMZ9DLlxrC
InChI InChI=1S/C21H28N2S/c1-3-12-23(20-7-4-6-18(2)17-20)19-9-13-22(14-10-19)15-11-21-8-5-16-24-21/h3-8,16-17,19H,1,9-15H2,2H3
InChIKey RKAIGNRPKQHVSK-UHFFFAOYSA-N
Mol Weight 340.53 g/mol
Molecular Formula C21H28N2S
Exact Mass 340.19732 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID DlAL05U1rQe
Name N-Allyl-N-(3-methylphenyl)-1-[2-(thiophen-2-yl)ethyl]piperidin-4-amine
Classification Fentanyl opioid
Copyright Copyright © 2024 DigiLab GmbH and Wiley-VCH GmbH. All Rights Reserved.
Exact Mass 340.197320084 u
Formula C21H28N2S
InChI InChI=1S/C21H28N2S/c1-3-12-23(20-7-4-6-18(2)17-20)19-9-13-22(14-10-19)15-11-21-8-5-16-24-21/h3-8,16-17,19H,1,9-15H2,2H3
InChIKey RKAIGNRPKQHVSK-UHFFFAOYSA-N
Ionization Type Electron Ionization (EI)
Molecular Weight 340.529 g/mol
Nominal Mass 340 u
Quality 968
Retention Index 2735
SMILES C1(N(C2=CC(=CC=C2)C)CC=C)CCN(CC1)CCC=1SC=CC1
SPLASH splash10-0007-9330000000-e3a8ca5c041fa178204b
Source of Spectrum DigiLab GmbH (C) 2024
Synonyms Fentanyl(-propionyl+allyl-phenyl+(3-methylphenyl)-phenethyl+(thiophen-2-yl-ethyl)) N-(3-methylphenyl)-N-(prop-2-en-1-yl)-1-(2-(thiophen-2-yl)ethyl)piperidin-4-amine
Technique GC/MS
Wiley ID DD2024_026687