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N-(3-Bromophenyl)-N-propyl-1-(2-phenylethyl)piperidin-4-amine
SpectraBase Compound ID Enj9MBLmcKC
InChI InChI=1S/C22H29BrN2/c1-2-14-25(22-10-6-9-20(23)18-22)21-12-16-24(17-13-21)15-11-19-7-4-3-5-8-19/h3-10,18,21H,2,11-17H2,1H3
InChIKey XQYOQQGBUSSVBA-UHFFFAOYSA-N
Mol Weight 401.39 g/mol
Molecular Formula C22H29BrN2
Exact Mass 400.151412 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID Dn5d8LlonfE
Name N-(3-Bromophenyl)-N-propyl-1-(2-phenylethyl)piperidin-4-amine
Classification Fentanyl opioid
Copyright Copyright © 2024 DigiLab GmbH and Wiley-VCH GmbH. All Rights Reserved.
Exact Mass 400.151411942 u
Formula C22H29BrN2
InChI InChI=1S/C22H29BrN2/c1-2-14-25(22-10-6-9-20(23)18-22)21-12-16-24(17-13-21)15-11-19-7-4-3-5-8-19/h3-10,18,21H,2,11-17H2,1H3
InChIKey XQYOQQGBUSSVBA-UHFFFAOYSA-N
Ionization Type Electron Ionization (EI)
Molecular Weight 401.392 g/mol
Nominal Mass 400 u
Quality 985
Retention Index 2890
SMILES C1(N(C=2C=C(C=CC2)Br)CCC)CCN(CC1)CCC=1C=CC=CC1
SPLASH splash10-0002-9643000000-a2534238232e5ae9f407
Source of Spectrum DigiLab GmbH (C) 2024
Synonyms Fentanyl(-propionyl+propyl-phenyl+(3-bromophenyl))
Technique GC/MS
Wiley ID DD2024_034010