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

*Links on SpectraBase are not permalinks.
3-Methylbenzylfentanyl II
SpectraBase Compound ID 3Hxw3AFJZZs
InChI InChI=1S/C22H28N2O/c1-3-22(25)24(20-12-8-5-9-13-20)21-14-15-23(16-18(21)2)17-19-10-6-4-7-11-19/h4-13,18,21H,3,14-17H2,1-2H3/t18-,21-/m0/s1
InChIKey MSAFCEWTMBDBFQ-RXVVDRJESA-N
Mol Weight 336.48 g/mol
Molecular Formula C22H28N2O
Exact Mass 336.220164 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 8GBhY16hdIW
Name 3-Methylbenzylfentanyl I
Classification 3-Methylfentanyl analog
Copyright Copyright © 2024 DigiLab GmbH and Wiley-VCH GmbH. All Rights Reserved.
Exact Mass 336.220163529 u
Formula C22H28N2O
InChI InChI=1S/C22H28N2O/c1-3-22(25)24(20-12-8-5-9-13-20)21-14-15-23(16-18(21)2)17-19-10-6-4-7-11-19/h4-13,18,21H,3,14-17H2,1-2H3/t18-,21-/m0/s1
InChIKey MSAFCEWTMBDBFQ-RXVVDRJESA-N
Ionization Type Electron Ionization (EI)
Molecular Weight 336.479 g/mol
Nominal Mass 336 u
Quality 953
Retention Index 2617
SMILES [C@]1(N(C2=CC=CC=C2)C(CC)=O)([C@](CN(CC1)CC=1C=CC=CC1)(C)[H])[H]
SPLASH splash10-000m-5910000000-d161fee2066a35899f66
Source of Spectrum DigiLab GmbH (C) 2024
Synonyms N-(1-Benzyl-3-methylpiperidin-4-yl)-N-phenyl-propanamide
Technique GC/MS
Wiley ID DD2024_008893