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N-(1-[2-(4-Fluorophenyl)ethyl]piperidin-4-yl)-N-(4-methylphenyl)thiophene-3-carboxamide
SpectraBase Compound ID 5IMgC4DDvkm
InChI InChI=1S/C25H27FN2OS/c1-19-2-8-23(9-3-19)28(25(29)21-13-17-30-18-21)24-11-15-27(16-12-24)14-10-20-4-6-22(26)7-5-20/h2-9,13,17-18,24H,10-12,14-16H2,1H3
InChIKey MSFMNQOQHSXENM-UHFFFAOYSA-N
Mol Weight 422.56 g/mol
Molecular Formula C25H27FN2OS
Exact Mass 422.182813 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 5XWPrqf8whU
Name N-(1-[2-(4-Fluorophenyl)ethyl]piperidin-4-yl)-N-(4-methylphenyl)thiophene-3-carboxamide
Classification Fentalogue
Comments Spectrum verified by independent measurements in external laboratories
Copyright Copyright © 2024 DigiLab GmbH and Wiley-VCH GmbH. All Rights Reserved.
Exact Mass 422.182812833 u
Formula C25H27FN2OS
InChI InChI=1S/C25H27FN2OS/c1-19-2-8-23(9-3-19)28(25(29)21-13-17-30-18-21)24-11-15-27(16-12-24)14-10-20-4-6-22(26)7-5-20/h2-9,13,17-18,24H,10-12,14-16H2,1H3
InChIKey MSFMNQOQHSXENM-UHFFFAOYSA-N
Ionization Type Electron Ionization (EI)
Molecular Weight 422.562 g/mol
Nominal Mass 422 u
Quality 976
Retention Index 3290
SMILES C1(N(C(C=2C=CSC2)=O)C2=CC=C(C=C2)C)CCN(CC1)CCC1=CC=C(C=C1)F
SPLASH splash10-03di-2923000000-7a468c87f7fd46fbe4fe
Source of Spectrum DigiLab GmbH (C) 2024
Synonyms Fentanyl(-propionyl+(thiophen-3-carbonyl)-phenyl+(4-methylphenyl)-phenethyl+[2-(4-fluorophenylethyl)])
Technique GC/MS
Wiley ID DD2024_030366