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N-(4-Chlorophenyl)-N-(1-[(2-thiophen-2-yl)ethyl]piperidin-4-yl)-4-ethylbenzamide
SpectraBase Compound ID 4iNmSiFYV0Q
InChI InChI=1S/C26H29ClN2OS/c1-2-20-5-7-21(8-6-20)26(30)29(23-11-9-22(27)10-12-23)24-13-16-28(17-14-24)18-15-25-4-3-19-31-25/h3-12,19,24H,2,13-18H2,1H3
InChIKey HIEYJAPNBAMSKY-UHFFFAOYSA-N
Mol Weight 453.04 g/mol
Molecular Formula C26H29ClN2OS
Exact Mass 452.168912 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID JIx3azNRDou
Name N-(4-Chlorophenyl)-N-(1-[(2-thiophen-2-yl)ethyl]piperidin-4-yl)-4-ethylbenzamide
Classification Fentanyl opioid
Copyright Copyright © 2024 DigiLab GmbH and Wiley-VCH GmbH. All Rights Reserved.
Exact Mass 452.168912435 u
Formula C26H29ClN2OS
InChI InChI=1S/C26H29ClN2OS/c1-2-20-5-7-21(8-6-20)26(30)29(23-11-9-22(27)10-12-23)24-13-16-28(17-14-24)18-15-25-4-3-19-31-25/h3-12,19,24H,2,13-18H2,1H3
InChIKey HIEYJAPNBAMSKY-UHFFFAOYSA-N
Ionization Type Electron Ionization (EI)
Molecular Weight 453.044 g/mol
Nominal Mass 452 u
Quality 1000
Retention Index 3417
SMILES C(N(C1CCN(CC1)CCC=1SC=CC1)C1=CC=C(C=C1)Cl)(C1=CC=C(C=C1)CC)=O
SPLASH splash10-053r-2904000000-fc4fd3e549d5e3178f6c
Source of Spectrum DigiLab GmbH (C) 2024
Synonyms Fentanyl(-propionyl+(4-Ethylbenzoyl-phenyl+4-chlorophenyl-phenethyl+(thiophen-2-yl-ethyl))
Technique GC/MS
Wiley ID DD2024_026840