For citations & permissions, please see: Citations & Permissions - Wiley Science Solutions*

*Links on SpectraBase are not permalinks.
N-(3-Bromophenyl)-3-methyl-N-[1-(2-phenylethyl)piperidin-4-yl]benzamide
SpectraBase Compound ID GXAh7BbvTq9
InChI InChI=1S/C27H29BrN2O/c1-21-7-5-10-23(19-21)27(31)30(26-12-6-11-24(28)20-26)25-14-17-29(18-15-25)16-13-22-8-3-2-4-9-22/h2-12,19-20,25H,13-18H2,1H3
InChIKey ITKJVSLJHXYWDI-UHFFFAOYSA-N
Mol Weight 477.45 g/mol
Molecular Formula C27H29BrN2O
Exact Mass 476.146327 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

View the Full Spectrum for FREE!

The full spectrum can only be viewed using a FREE account.

SpectraBase Spectrum ID 8IgfQwVZHPM
Name N-(3-Bromophenyl)-3-methyl-N-[1-(2-phenylethyl)piperidin-4-yl]benzamide
Classification Fentanyl opioid
Copyright Copyright © 2024 DigiLab GmbH and Wiley-VCH GmbH. All Rights Reserved.
Exact Mass 476.146326561 u
Formula C27H29BrN2O
InChI InChI=1S/C27H29BrN2O/c1-21-7-5-10-23(19-21)27(31)30(26-12-6-11-24(28)20-26)25-14-17-29(18-15-25)16-13-22-8-3-2-4-9-22/h2-12,19-20,25H,13-18H2,1H3
InChIKey ITKJVSLJHXYWDI-UHFFFAOYSA-N
Ionization Type Electron Ionization (EI)
Molecular Weight 477.446 g/mol
Nominal Mass 476 u
Quality 999
Retention Index 3489
SMILES C=1(N(C(C=2C=C(C=CC2)C)=O)C2CCN(CC2)CCC=2C=CC=CC2)C=C(C=CC1)Br
SPLASH splash10-014i-2914000000-a5890ce6347ac5f21b38
Source of Spectrum DigiLab GmbH (C) 2024
Synonyms Fentanyl(-propionyl+(3-methylbenzoyl)-phenyl+(3-bromophenyl))
Technique GC/MS
Wiley ID DD2024_034035