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N-(3-Bromophenyl)-N-[1-(2-phenylethyl)piperidin-4-yl]acetamide
SpectraBase Compound ID HVRx72zI84A
InChI InChI=1S/C21H25BrN2O/c1-17(25)24(21-9-5-8-19(22)16-21)20-11-14-23(15-12-20)13-10-18-6-3-2-4-7-18/h2-9,16,20H,10-15H2,1H3
InChIKey UHGRBIPMDLIYLU-UHFFFAOYSA-N
Mol Weight 401.35 g/mol
Molecular Formula C21H25BrN2O
Exact Mass 400.115026 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 5VajqeyZERM
Name N-(3-Bromophenyl)-N-[1-(2-phenylethyl)piperidin-4-yl]acetamide
Classification Fentanyl opioid
Copyright Copyright © 2024 DigiLab GmbH and Wiley-VCH GmbH. All Rights Reserved.
Exact Mass 400.115026432 u
Formula C21H25BrN2O
InChI InChI=1S/C21H25BrN2O/c1-17(25)24(21-9-5-8-19(22)16-21)20-11-14-23(15-12-20)13-10-18-6-3-2-4-7-18/h2-9,16,20H,10-15H2,1H3
InChIKey UHGRBIPMDLIYLU-UHFFFAOYSA-N
Ionization Type Electron Ionization (EI)
Molecular Weight 401.348 g/mol
Nominal Mass 400 u
Quality 998
Retention Index 2918
SMILES C=1(N(C2CCN(CC2)CCC=2C=CC=CC2)C(=O)C)C=C(C=CC1)Br
SPLASH splash10-0993-4396000000-1cf784209dbecb0c8027
Source of Spectrum DigiLab GmbH (C) 2024
Synonyms Fentanyl(-propionyl+acetyl-phenyl+(3-bromophenyl))
Technique GC/MS
Wiley ID DD2024_034024