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N-(3-Bromophenyl)-N-butyl-1-(2-phenylethyl)piperidin-4-amine
SpectraBase Compound ID 5F5dQd3jybQ
InChI InChI=1S/C23H31BrN2/c1-2-3-15-26(23-11-7-10-21(24)19-23)22-13-17-25(18-14-22)16-12-20-8-5-4-6-9-20/h4-11,19,22H,2-3,12-18H2,1H3
InChIKey VWVSVJRPGSBLOS-UHFFFAOYSA-N
Mol Weight 415.42 g/mol
Molecular Formula C23H31BrN2
Exact Mass 414.167062 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID B2k6cNkRZeS
Name N-(3-Bromophenyl)-N-butyl-1-(2-phenylethyl)piperidin-4-amine
Classification Fentanyl opioid
Copyright Copyright © 2024 DigiLab GmbH and Wiley-VCH GmbH. All Rights Reserved.
Exact Mass 414.167062006 u
Formula C23H31BrN2
InChI InChI=1S/C23H31BrN2/c1-2-3-15-26(23-11-7-10-21(24)19-23)22-13-17-25(18-14-22)16-12-20-8-5-4-6-9-20/h4-11,19,22H,2-3,12-18H2,1H3
InChIKey VWVSVJRPGSBLOS-UHFFFAOYSA-N
Ionization Type Electron Ionization (EI)
Molecular Weight 415.419 g/mol
Nominal Mass 414 u
Quality 981
Retention Index 2984
SMILES C=1(N(C2CCN(CC2)CCC=2C=CC=CC2)CCCC)C=C(C=CC1)Br
SPLASH splash10-0002-9532000000-81b53c99713327724e63
Source of Spectrum DigiLab GmbH (C) 2024
Synonyms Fentanyl(-propionyl+butyl-phenyl+(3-bromophenyl))
Technique GC/MS
Wiley ID DD2024_034013